data_25855 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25855 _Entry.Title ; Zipcode-binding-protein-1 KH3(DD)KH4 domains in complex with the RNA target UCGGACU ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-10-21 _Entry.Accession_date 2015-10-21 _Entry.Last_release_date 2015-10-23 _Entry.Original_release_date 2015-10-23 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Giuseppe Nicastro . . . . 25855 2 Andres Ramos . . . . 25855 3 Adela Candel . . . . 25855 4 David Hollingworth . . . . 25855 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 25855 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'KH Domain' . 25855 'NMR Solution Structure' . 25855 'RNA Binding Protein' . 25855 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25855 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2017-01-19 . original BMRB . 25855 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 25854 'Zipcode-binding-protein-1 KH3KH4(DD) domains in complex with the RNA target CACACCC' 25855 PDB 2N8L 'BMRB Entry Tracking System' 25855 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25855 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22547390 _Citation.Full_citation . _Citation.Title ; KH domains with impaired nucleic acid binding as a tool for functional analysis. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nucleic Acids Res.' _Citation.Journal_name_full . _Citation.Journal_volume 40 _Citation.Journal_issue 14 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 6873 _Citation.Page_last 6886 _Citation.Year 2012 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 David Hollingworth . . . . 25855 1 2 Adela Candel . M. . . 25855 1 3 Giuseppe Nicastro . . . . 25855 1 4 Stephen Martin . R. . . 25855 1 5 Paola Briata . . . . 25855 1 6 Roberto Gherzi . . . . 25855 1 7 Andres Ramos . . . . 25855 1 stop_ save_ save_citation2 _Citation.Sf_category citations _Citation.Sf_framecode citation2 _Citation.Entry_ID 25855 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20080952 _Citation.Full_citation . _Citation.Title ; ZBP1 recognition of beta-actin zipcode induces RNA looping. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Genes Dev.' _Citation.Journal_name_full . _Citation.Journal_volume 24 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 148 _Citation.Page_last 158 _Citation.Year 2010 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Jeffrey Chao . A. . . 25855 2 2 Yury Patskovsky . . . . 25855 2 3 Vivek Patel . . . . 25855 2 4 Matthew Levy . . . . 25855 2 5 Steven Almo . C. . . 25855 2 6 Robert Singer . H. . . 25855 2 stop_ save_ save_citation3 _Citation.Sf_category citations _Citation.Sf_framecode citation3 _Citation.Entry_ID 25855 _Citation.ID 3 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22215810 _Citation.Full_citation . _Citation.Title ; Spatial arrangement of an RNA zipcode identifies mRNAs under post-transcriptional control. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Genes Dev.' _Citation.Journal_name_full . _Citation.Journal_volume 26 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 43 _Citation.Page_last 53 _Citation.Year 2012 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Vivek Patel . L. . . 25855 3 2 Somdeb Mitra . . . . 25855 3 3 Richard Harris . . . . 25855 3 4 Adina Buxbaum . R. . . 25855 3 5 Timothee Lionnet . . . . 25855 3 6 Michael Brenowitz . . . . 25855 3 7 Mark Girvin . . . . 25855 3 8 Matthew Levy . . . . 25855 3 9 Steven Almo . C. . . 25855 3 10 Robert Singer . H. . . 25855 3 11 Jeffrey Chao . A. . . 25855 3 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25855 _Assembly.ID 1 _Assembly.Name 'Zipcode-binding-protein-1 KH3(DD)KH4 domains in complex with the RNA target UCGGACU' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A . yes native no no . . . 25855 1 2 entity_2 2 $entity_2 B . no native no no . . . 25855 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 25855 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GAMGPSSVSGAAPFSSFMPP EQETVHVFIPAQAVGAIIGK KGQHIKQLSRFASASIKIAP PETPDSKVRMVVITGPPEAQ FKAQGRIYGKLKEENFFGPK EEVKLETHIRVPASAAGRVI GKGGKTVNELQNLTAAEVVV PRDQTPDENEQVIVKIIGHF YASQMAQRKIRDILAQVKQQ HQKGQSGQLQA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 191 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 20613.682 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 25855 1 2 . ALA . 25855 1 3 . MET . 25855 1 4 . GLY . 25855 1 5 . PRO . 25855 1 6 . SER . 25855 1 7 . SER . 25855 1 8 . VAL . 25855 1 9 . SER . 25855 1 10 . GLY . 25855 1 11 . ALA . 25855 1 12 . ALA . 25855 1 13 . PRO . 25855 1 14 . PHE . 25855 1 15 . SER . 25855 1 16 . SER . 25855 1 17 . PHE . 25855 1 18 . MET . 25855 1 19 . PRO . 25855 1 20 . PRO . 25855 1 21 . GLU . 25855 1 22 . GLN . 25855 1 23 . GLU . 25855 1 24 . THR . 25855 1 25 . VAL . 25855 1 26 . HIS . 25855 1 27 . VAL . 25855 1 28 . PHE . 25855 1 29 . ILE . 25855 1 30 . PRO . 25855 1 31 . ALA . 25855 1 32 . GLN . 25855 1 33 . ALA . 25855 1 34 . VAL . 25855 1 35 . GLY . 25855 1 36 . ALA . 25855 1 37 . ILE . 25855 1 38 . ILE . 25855 1 39 . GLY . 25855 1 40 . LYS . 25855 1 41 . LYS . 25855 1 42 . GLY . 25855 1 43 . GLN . 25855 1 44 . HIS . 25855 1 45 . ILE . 25855 1 46 . LYS . 25855 1 47 . GLN . 25855 1 48 . LEU . 25855 1 49 . SER . 25855 1 50 . ARG . 25855 1 51 . PHE . 25855 1 52 . ALA . 25855 1 53 . SER . 25855 1 54 . ALA . 25855 1 55 . SER . 25855 1 56 . ILE . 25855 1 57 . LYS . 25855 1 58 . ILE . 25855 1 59 . ALA . 25855 1 60 . PRO . 25855 1 61 . PRO . 25855 1 62 . GLU . 25855 1 63 . THR . 25855 1 64 . PRO . 25855 1 65 . ASP . 25855 1 66 . SER . 25855 1 67 . LYS . 25855 1 68 . VAL . 25855 1 69 . ARG . 25855 1 70 . MET . 25855 1 71 . VAL . 25855 1 72 . VAL . 25855 1 73 . ILE . 25855 1 74 . THR . 25855 1 75 . GLY . 25855 1 76 . PRO . 25855 1 77 . PRO . 25855 1 78 . GLU . 25855 1 79 . ALA . 25855 1 80 . GLN . 25855 1 81 . PHE . 25855 1 82 . LYS . 25855 1 83 . ALA . 25855 1 84 . GLN . 25855 1 85 . GLY . 25855 1 86 . ARG . 25855 1 87 . ILE . 25855 1 88 . TYR . 25855 1 89 . GLY . 25855 1 90 . LYS . 25855 1 91 . LEU . 25855 1 92 . LYS . 25855 1 93 . GLU . 25855 1 94 . GLU . 25855 1 95 . ASN . 25855 1 96 . PHE . 25855 1 97 . PHE . 25855 1 98 . GLY . 25855 1 99 . PRO . 25855 1 100 . LYS . 25855 1 101 . GLU . 25855 1 102 . GLU . 25855 1 103 . VAL . 25855 1 104 . LYS . 25855 1 105 . LEU . 25855 1 106 . GLU . 25855 1 107 . THR . 25855 1 108 . HIS . 25855 1 109 . ILE . 25855 1 110 . ARG . 25855 1 111 . VAL . 25855 1 112 . PRO . 25855 1 113 . ALA . 25855 1 114 . SER . 25855 1 115 . ALA . 25855 1 116 . ALA . 25855 1 117 . GLY . 25855 1 118 . ARG . 25855 1 119 . VAL . 25855 1 120 . ILE . 25855 1 121 . GLY . 25855 1 122 . LYS . 25855 1 123 . GLY . 25855 1 124 . GLY . 25855 1 125 . LYS . 25855 1 126 . THR . 25855 1 127 . VAL . 25855 1 128 . ASN . 25855 1 129 . GLU . 25855 1 130 . LEU . 25855 1 131 . GLN . 25855 1 132 . ASN . 25855 1 133 . LEU . 25855 1 134 . THR . 25855 1 135 . ALA . 25855 1 136 . ALA . 25855 1 137 . GLU . 25855 1 138 . VAL . 25855 1 139 . VAL . 25855 1 140 . VAL . 25855 1 141 . PRO . 25855 1 142 . ARG . 25855 1 143 . ASP . 25855 1 144 . GLN . 25855 1 145 . THR . 25855 1 146 . PRO . 25855 1 147 . ASP . 25855 1 148 . GLU . 25855 1 149 . ASN . 25855 1 150 . GLU . 25855 1 151 . GLN . 25855 1 152 . VAL . 25855 1 153 . ILE . 25855 1 154 . VAL . 25855 1 155 . LYS . 25855 1 156 . ILE . 25855 1 157 . ILE . 25855 1 158 . GLY . 25855 1 159 . HIS . 25855 1 160 . PHE . 25855 1 161 . TYR . 25855 1 162 . ALA . 25855 1 163 . SER . 25855 1 164 . GLN . 25855 1 165 . MET . 25855 1 166 . ALA . 25855 1 167 . GLN . 25855 1 168 . ARG . 25855 1 169 . LYS . 25855 1 170 . ILE . 25855 1 171 . ARG . 25855 1 172 . ASP . 25855 1 173 . ILE . 25855 1 174 . LEU . 25855 1 175 . ALA . 25855 1 176 . GLN . 25855 1 177 . VAL . 25855 1 178 . LYS . 25855 1 179 . GLN . 25855 1 180 . GLN . 25855 1 181 . HIS . 25855 1 182 . GLN . 25855 1 183 . LYS . 25855 1 184 . GLY . 25855 1 185 . GLN . 25855 1 186 . SER . 25855 1 187 . GLY . 25855 1 188 . GLN . 25855 1 189 . LEU . 25855 1 190 . GLN . 25855 1 191 . ALA . 25855 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 25855 1 . ALA 2 2 25855 1 . MET 3 3 25855 1 . GLY 4 4 25855 1 . PRO 5 5 25855 1 . SER 6 6 25855 1 . SER 7 7 25855 1 . VAL 8 8 25855 1 . SER 9 9 25855 1 . GLY 10 10 25855 1 . ALA 11 11 25855 1 . ALA 12 12 25855 1 . PRO 13 13 25855 1 . PHE 14 14 25855 1 . SER 15 15 25855 1 . SER 16 16 25855 1 . PHE 17 17 25855 1 . MET 18 18 25855 1 . PRO 19 19 25855 1 . PRO 20 20 25855 1 . GLU 21 21 25855 1 . GLN 22 22 25855 1 . GLU 23 23 25855 1 . THR 24 24 25855 1 . VAL 25 25 25855 1 . HIS 26 26 25855 1 . VAL 27 27 25855 1 . PHE 28 28 25855 1 . ILE 29 29 25855 1 . PRO 30 30 25855 1 . ALA 31 31 25855 1 . GLN 32 32 25855 1 . ALA 33 33 25855 1 . VAL 34 34 25855 1 . GLY 35 35 25855 1 . ALA 36 36 25855 1 . ILE 37 37 25855 1 . ILE 38 38 25855 1 . GLY 39 39 25855 1 . LYS 40 40 25855 1 . LYS 41 41 25855 1 . GLY 42 42 25855 1 . GLN 43 43 25855 1 . HIS 44 44 25855 1 . ILE 45 45 25855 1 . LYS 46 46 25855 1 . GLN 47 47 25855 1 . LEU 48 48 25855 1 . SER 49 49 25855 1 . ARG 50 50 25855 1 . PHE 51 51 25855 1 . ALA 52 52 25855 1 . SER 53 53 25855 1 . ALA 54 54 25855 1 . SER 55 55 25855 1 . ILE 56 56 25855 1 . LYS 57 57 25855 1 . ILE 58 58 25855 1 . ALA 59 59 25855 1 . PRO 60 60 25855 1 . PRO 61 61 25855 1 . GLU 62 62 25855 1 . THR 63 63 25855 1 . PRO 64 64 25855 1 . ASP 65 65 25855 1 . SER 66 66 25855 1 . LYS 67 67 25855 1 . VAL 68 68 25855 1 . ARG 69 69 25855 1 . MET 70 70 25855 1 . VAL 71 71 25855 1 . VAL 72 72 25855 1 . ILE 73 73 25855 1 . THR 74 74 25855 1 . GLY 75 75 25855 1 . PRO 76 76 25855 1 . PRO 77 77 25855 1 . GLU 78 78 25855 1 . ALA 79 79 25855 1 . GLN 80 80 25855 1 . PHE 81 81 25855 1 . LYS 82 82 25855 1 . ALA 83 83 25855 1 . GLN 84 84 25855 1 . GLY 85 85 25855 1 . ARG 86 86 25855 1 . ILE 87 87 25855 1 . TYR 88 88 25855 1 . GLY 89 89 25855 1 . LYS 90 90 25855 1 . LEU 91 91 25855 1 . LYS 92 92 25855 1 . GLU 93 93 25855 1 . GLU 94 94 25855 1 . ASN 95 95 25855 1 . PHE 96 96 25855 1 . PHE 97 97 25855 1 . GLY 98 98 25855 1 . PRO 99 99 25855 1 . LYS 100 100 25855 1 . GLU 101 101 25855 1 . GLU 102 102 25855 1 . VAL 103 103 25855 1 . LYS 104 104 25855 1 . LEU 105 105 25855 1 . GLU 106 106 25855 1 . THR 107 107 25855 1 . HIS 108 108 25855 1 . ILE 109 109 25855 1 . ARG 110 110 25855 1 . VAL 111 111 25855 1 . PRO 112 112 25855 1 . ALA 113 113 25855 1 . SER 114 114 25855 1 . ALA 115 115 25855 1 . ALA 116 116 25855 1 . GLY 117 117 25855 1 . ARG 118 118 25855 1 . VAL 119 119 25855 1 . ILE 120 120 25855 1 . GLY 121 121 25855 1 . LYS 122 122 25855 1 . GLY 123 123 25855 1 . GLY 124 124 25855 1 . LYS 125 125 25855 1 . THR 126 126 25855 1 . VAL 127 127 25855 1 . ASN 128 128 25855 1 . GLU 129 129 25855 1 . LEU 130 130 25855 1 . GLN 131 131 25855 1 . ASN 132 132 25855 1 . LEU 133 133 25855 1 . THR 134 134 25855 1 . ALA 135 135 25855 1 . ALA 136 136 25855 1 . GLU 137 137 25855 1 . VAL 138 138 25855 1 . VAL 139 139 25855 1 . VAL 140 140 25855 1 . PRO 141 141 25855 1 . ARG 142 142 25855 1 . ASP 143 143 25855 1 . GLN 144 144 25855 1 . THR 145 145 25855 1 . PRO 146 146 25855 1 . ASP 147 147 25855 1 . GLU 148 148 25855 1 . ASN 149 149 25855 1 . GLU 150 150 25855 1 . GLN 151 151 25855 1 . VAL 152 152 25855 1 . ILE 153 153 25855 1 . VAL 154 154 25855 1 . LYS 155 155 25855 1 . ILE 156 156 25855 1 . ILE 157 157 25855 1 . GLY 158 158 25855 1 . HIS 159 159 25855 1 . PHE 160 160 25855 1 . TYR 161 161 25855 1 . ALA 162 162 25855 1 . SER 163 163 25855 1 . GLN 164 164 25855 1 . MET 165 165 25855 1 . ALA 166 166 25855 1 . GLN 167 167 25855 1 . ARG 168 168 25855 1 . LYS 169 169 25855 1 . ILE 170 170 25855 1 . ARG 171 171 25855 1 . ASP 172 172 25855 1 . ILE 173 173 25855 1 . LEU 174 174 25855 1 . ALA 175 175 25855 1 . GLN 176 176 25855 1 . VAL 177 177 25855 1 . LYS 178 178 25855 1 . GLN 179 179 25855 1 . GLN 180 180 25855 1 . HIS 181 181 25855 1 . GLN 182 182 25855 1 . LYS 183 183 25855 1 . GLY 184 184 25855 1 . GLN 185 185 25855 1 . SER 186 186 25855 1 . GLY 187 187 25855 1 . GLN 188 188 25855 1 . LEU 189 189 25855 1 . GLN 190 190 25855 1 . ALA 191 191 25855 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 25855 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; UCGGACU ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 8 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . U . 25855 2 2 . C . 25855 2 3 . G . 25855 2 4 . G . 25855 2 5 . A . 25855 2 6 . C . 25855 2 7 . U . 25855 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . U 1 1 25855 2 . C 2 2 25855 2 . G 3 3 25855 2 . G 4 4 25855 2 . A 5 5 25855 2 . C 6 6 25855 2 . U 7 7 25855 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 25855 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . 25855 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 25855 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . 25855 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25855 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 0.3 . . mM . . . . 25855 1 2 entity_2 'natural abundance' . . 2 $entity_2 . . 0.3 . . mM . . . . 25855 1 3 'phosphate buffer' 'natural abundance' . . . . . . 20 . . mM . . . . 25855 1 4 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 25855 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 25855 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.02 . M 25855 1 pH 6.5 . pH 25855 1 pressure 1 . atm 25855 1 temperature 310 . K 25855 1 stop_ save_ ############################ # Computer software used # ############################ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 25855 _Software.ID 1 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 25855 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25855 1 stop_ save_ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 25855 _Software.ID 2 _Software.Name ARIA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . 25855 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25855 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25855 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25855 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 25855 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 25855 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 950 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 25855 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 800 . . . 25855 1 2 spectrometer_2 Bruker Avance . 600 . . . 25855 1 3 spectrometer_3 Bruker Avance . 700 . . . 25855 1 4 spectrometer_4 Bruker Avance . 950 . . . 25855 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 25855 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25855 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25855 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25855 1 4 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25855 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 25855 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 25855 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 25855 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 25855 1 P 31 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.404808636 . . . . . 25855 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25855 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 4 '3D 1H-13C NOESY' . . . 25855 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XEASY . . 25855 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 22 22 GLN H H 1 8.152 0.000 . . . . . A 22 GLN H . 25855 1 2 . 1 1 22 22 GLN HG2 H 1 2.241 0.001 . . . . . A 22 GLN HG2 . 25855 1 3 . 1 1 22 22 GLN HG3 H 1 2.127 0.001 . . . . . A 22 GLN HG3 . 25855 1 4 . 1 1 22 22 GLN HE21 H 1 7.423 0.000 . . . . . A 22 GLN HE21 . 25855 1 5 . 1 1 22 22 GLN HE22 H 1 6.718 0.000 . . . . . A 22 GLN HE22 . 25855 1 6 . 1 1 22 22 GLN CG C 13 34.067 0.000 . . . . . A 22 GLN CG . 25855 1 7 . 1 1 23 23 GLU H H 1 7.926 0.000 . . . . . A 23 GLU H . 25855 1 8 . 1 1 23 23 GLU HA H 1 4.576 0.011 . . . . . A 23 GLU HA . 25855 1 9 . 1 1 23 23 GLU HB2 H 1 1.970 0.009 . . . . . A 23 GLU HB2 . 25855 1 10 . 1 1 23 23 GLU HB3 H 1 1.970 0.009 . . . . . A 23 GLU HB3 . 25855 1 11 . 1 1 23 23 GLU HG2 H 1 2.206 0.005 . . . . . A 23 GLU HG2 . 25855 1 12 . 1 1 23 23 GLU HG3 H 1 2.206 0.005 . . . . . A 23 GLU HG3 . 25855 1 13 . 1 1 23 23 GLU CA C 13 55.105 0.256 . . . . . A 23 GLU CA . 25855 1 14 . 1 1 23 23 GLU CB C 13 32.431 0.000 . . . . . A 23 GLU CB . 25855 1 15 . 1 1 23 23 GLU CG C 13 36.077 0.000 . . . . . A 23 GLU CG . 25855 1 16 . 1 1 24 24 THR HA H 1 5.298 0.010 . . . . . A 24 THR HA . 25855 1 17 . 1 1 24 24 THR HB H 1 3.749 0.002 . . . . . A 24 THR HB . 25855 1 18 . 1 1 24 24 THR HG21 H 1 1.034 0.003 . . . . . A 24 THR HG21 . 25855 1 19 . 1 1 24 24 THR HG22 H 1 1.034 0.003 . . . . . A 24 THR HG22 . 25855 1 20 . 1 1 24 24 THR HG23 H 1 1.034 0.003 . . . . . A 24 THR HG23 . 25855 1 21 . 1 1 24 24 THR CA C 13 62.286 0.032 . . . . . A 24 THR CA . 25855 1 22 . 1 1 24 24 THR CB C 13 70.759 0.112 . . . . . A 24 THR CB . 25855 1 23 . 1 1 24 24 THR CG2 C 13 21.869 0.061 . . . . . A 24 THR CG2 . 25855 1 24 . 1 1 25 25 VAL HA H 1 4.435 0.002 . . . . . A 25 VAL HA . 25855 1 25 . 1 1 25 25 VAL HB H 1 1.989 0.002 . . . . . A 25 VAL HB . 25855 1 26 . 1 1 25 25 VAL HG11 H 1 0.833 0.045 . . . . . A 25 VAL HG11 . 25855 1 27 . 1 1 25 25 VAL HG12 H 1 0.833 0.045 . . . . . A 25 VAL HG12 . 25855 1 28 . 1 1 25 25 VAL HG13 H 1 0.833 0.045 . . . . . A 25 VAL HG13 . 25855 1 29 . 1 1 25 25 VAL HG21 H 1 0.790 0.018 . . . . . A 25 VAL HG21 . 25855 1 30 . 1 1 25 25 VAL HG22 H 1 0.790 0.018 . . . . . A 25 VAL HG22 . 25855 1 31 . 1 1 25 25 VAL HG23 H 1 0.790 0.018 . . . . . A 25 VAL HG23 . 25855 1 32 . 1 1 25 25 VAL CA C 13 60.621 0.056 . . . . . A 25 VAL CA . 25855 1 33 . 1 1 25 25 VAL CB C 13 35.023 0.000 . . . . . A 25 VAL CB . 25855 1 34 . 1 1 25 25 VAL CG1 C 13 21.275 0.112 . . . . . A 25 VAL CG1 . 25855 1 35 . 1 1 25 25 VAL CG2 C 13 21.337 0.076 . . . . . A 25 VAL CG2 . 25855 1 36 . 1 1 26 26 HIS HA H 1 5.539 0.319 . . . . . A 26 HIS HA . 25855 1 37 . 1 1 26 26 HIS HB2 H 1 3.104 0.021 . . . . . A 26 HIS HB2 . 25855 1 38 . 1 1 26 26 HIS HB3 H 1 2.434 0.000 . . . . . A 26 HIS HB3 . 25855 1 39 . 1 1 26 26 HIS HD2 H 1 6.716 0.014 . . . . . A 26 HIS HD2 . 25855 1 40 . 1 1 26 26 HIS CA C 13 52.142 0.094 . . . . . A 26 HIS CA . 25855 1 41 . 1 1 27 27 VAL H H 1 9.339 0.000 . . . . . A 27 VAL H . 25855 1 42 . 1 1 27 27 VAL HA H 1 4.717 0.007 . . . . . A 27 VAL HA . 25855 1 43 . 1 1 27 27 VAL HB H 1 1.680 0.010 . . . . . A 27 VAL HB . 25855 1 44 . 1 1 27 27 VAL HG11 H 1 0.876 0.004 . . . . . A 27 VAL HG11 . 25855 1 45 . 1 1 27 27 VAL HG12 H 1 0.876 0.004 . . . . . A 27 VAL HG12 . 25855 1 46 . 1 1 27 27 VAL HG13 H 1 0.876 0.004 . . . . . A 27 VAL HG13 . 25855 1 47 . 1 1 27 27 VAL HG21 H 1 0.723 0.045 . . . . . A 27 VAL HG21 . 25855 1 48 . 1 1 27 27 VAL HG22 H 1 0.723 0.045 . . . . . A 27 VAL HG22 . 25855 1 49 . 1 1 27 27 VAL HG23 H 1 0.723 0.045 . . . . . A 27 VAL HG23 . 25855 1 50 . 1 1 27 27 VAL CA C 13 60.635 0.057 . . . . . A 27 VAL CA . 25855 1 51 . 1 1 27 27 VAL CB C 13 35.238 0.206 . . . . . A 27 VAL CB . 25855 1 52 . 1 1 27 27 VAL CG1 C 13 21.875 0.154 . . . . . A 27 VAL CG1 . 25855 1 53 . 1 1 27 27 VAL CG2 C 13 21.431 0.079 . . . . . A 27 VAL CG2 . 25855 1 54 . 1 1 28 28 PHE HA H 1 4.911 0.016 . . . . . A 28 PHE HA . 25855 1 55 . 1 1 28 28 PHE HB2 H 1 2.952 0.018 . . . . . A 28 PHE HB2 . 25855 1 56 . 1 1 28 28 PHE HB3 H 1 2.476 0.004 . . . . . A 28 PHE HB3 . 25855 1 57 . 1 1 28 28 PHE HD1 H 1 6.766 0.010 . . . . . A 28 PHE HD1 . 25855 1 58 . 1 1 28 28 PHE HD2 H 1 6.766 0.010 . . . . . A 28 PHE HD2 . 25855 1 59 . 1 1 28 28 PHE HE1 H 1 6.336 0.000 . . . . . A 28 PHE HE1 . 25855 1 60 . 1 1 28 28 PHE HE2 H 1 6.336 0.000 . . . . . A 28 PHE HE2 . 25855 1 61 . 1 1 28 28 PHE CA C 13 57.725 0.363 . . . . . A 28 PHE CA . 25855 1 62 . 1 1 28 28 PHE CB C 13 38.909 0.024 . . . . . A 28 PHE CB . 25855 1 63 . 1 1 29 29 ILE HA H 1 4.886 0.007 . . . . . A 29 ILE HA . 25855 1 64 . 1 1 29 29 ILE HB H 1 1.487 0.007 . . . . . A 29 ILE HB . 25855 1 65 . 1 1 29 29 ILE HG12 H 1 1.189 0.010 . . . . . A 29 ILE HG12 . 25855 1 66 . 1 1 29 29 ILE HG13 H 1 0.812 0.065 . . . . . A 29 ILE HG13 . 25855 1 67 . 1 1 29 29 ILE HG21 H 1 0.591 0.007 . . . . . A 29 ILE HG21 . 25855 1 68 . 1 1 29 29 ILE HG22 H 1 0.591 0.007 . . . . . A 29 ILE HG22 . 25855 1 69 . 1 1 29 29 ILE HG23 H 1 0.591 0.007 . . . . . A 29 ILE HG23 . 25855 1 70 . 1 1 29 29 ILE HD11 H 1 0.341 0.082 . . . . . A 29 ILE HD11 . 25855 1 71 . 1 1 29 29 ILE HD12 H 1 0.341 0.082 . . . . . A 29 ILE HD12 . 25855 1 72 . 1 1 29 29 ILE HD13 H 1 0.341 0.082 . . . . . A 29 ILE HD13 . 25855 1 73 . 1 1 29 29 ILE CA C 13 57.114 0.086 . . . . . A 29 ILE CA . 25855 1 74 . 1 1 29 29 ILE CB C 13 38.915 0.034 . . . . . A 29 ILE CB . 25855 1 75 . 1 1 29 29 ILE CG1 C 13 23.574 0.150 . . . . . A 29 ILE CG1 . 25855 1 76 . 1 1 29 29 ILE CG2 C 13 17.615 0.028 . . . . . A 29 ILE CG2 . 25855 1 77 . 1 1 29 29 ILE CD1 C 13 14.440 1.366 . . . . . A 29 ILE CD1 . 25855 1 78 . 1 1 30 30 PRO HA H 1 4.508 0.014 . . . . . A 30 PRO HA . 25855 1 79 . 1 1 30 30 PRO HB2 H 1 2.466 0.008 . . . . . A 30 PRO HB2 . 25855 1 80 . 1 1 30 30 PRO HB3 H 1 1.494 0.003 . . . . . A 30 PRO HB3 . 25855 1 81 . 1 1 30 30 PRO HG2 H 1 1.928 0.002 . . . . . A 30 PRO HG2 . 25855 1 82 . 1 1 30 30 PRO HG3 H 1 1.928 0.002 . . . . . A 30 PRO HG3 . 25855 1 83 . 1 1 30 30 PRO HD2 H 1 3.690 0.008 . . . . . A 30 PRO HD2 . 25855 1 84 . 1 1 30 30 PRO HD3 H 1 3.159 0.010 . . . . . A 30 PRO HD3 . 25855 1 85 . 1 1 30 30 PRO CA C 13 62.909 0.082 . . . . . A 30 PRO CA . 25855 1 86 . 1 1 30 30 PRO CB C 13 31.841 0.461 . . . . . A 30 PRO CB . 25855 1 87 . 1 1 30 30 PRO CG C 13 27.650 0.000 . . . . . A 30 PRO CG . 25855 1 88 . 1 1 30 30 PRO CD C 13 50.274 0.104 . . . . . A 30 PRO CD . 25855 1 89 . 1 1 31 31 ALA HA H 1 3.593 0.006 . . . . . A 31 ALA HA . 25855 1 90 . 1 1 31 31 ALA HB1 H 1 1.213 0.010 . . . . . A 31 ALA HB1 . 25855 1 91 . 1 1 31 31 ALA HB2 H 1 1.213 0.010 . . . . . A 31 ALA HB2 . 25855 1 92 . 1 1 31 31 ALA HB3 H 1 1.213 0.010 . . . . . A 31 ALA HB3 . 25855 1 93 . 1 1 31 31 ALA CA C 13 55.496 0.089 . . . . . A 31 ALA CA . 25855 1 94 . 1 1 31 31 ALA CB C 13 18.071 0.102 . . . . . A 31 ALA CB . 25855 1 95 . 1 1 32 32 GLN HA H 1 4.183 0.008 . . . . . A 32 GLN HA . 25855 1 96 . 1 1 32 32 GLN HB2 H 1 2.201 0.000 . . . . . A 32 GLN HB2 . 25855 1 97 . 1 1 32 32 GLN HB3 H 1 2.104 0.014 . . . . . A 32 GLN HB3 . 25855 1 98 . 1 1 32 32 GLN HG2 H 1 2.550 0.016 . . . . . A 32 GLN HG2 . 25855 1 99 . 1 1 32 32 GLN HG3 H 1 2.349 0.017 . . . . . A 32 GLN HG3 . 25855 1 100 . 1 1 32 32 GLN CA C 13 57.341 0.000 . . . . . A 32 GLN CA . 25855 1 101 . 1 1 32 32 GLN CB C 13 27.867 0.264 . . . . . A 32 GLN CB . 25855 1 102 . 1 1 32 32 GLN CG C 13 34.063 0.282 . . . . . A 32 GLN CG . 25855 1 103 . 1 1 33 33 ALA HA H 1 3.958 0.009 . . . . . A 33 ALA HA . 25855 1 104 . 1 1 33 33 ALA HB1 H 1 0.422 0.003 . . . . . A 33 ALA HB1 . 25855 1 105 . 1 1 33 33 ALA HB2 H 1 0.422 0.003 . . . . . A 33 ALA HB2 . 25855 1 106 . 1 1 33 33 ALA HB3 H 1 0.422 0.003 . . . . . A 33 ALA HB3 . 25855 1 107 . 1 1 33 33 ALA CA C 13 51.416 0.057 . . . . . A 33 ALA CA . 25855 1 108 . 1 1 33 33 ALA CB C 13 19.084 0.153 . . . . . A 33 ALA CB . 25855 1 109 . 1 1 34 34 VAL HA H 1 2.886 0.007 . . . . . A 34 VAL HA . 25855 1 110 . 1 1 34 34 VAL HB H 1 1.800 0.011 . . . . . A 34 VAL HB . 25855 1 111 . 1 1 34 34 VAL HG11 H 1 0.831 0.046 . . . . . A 34 VAL HG11 . 25855 1 112 . 1 1 34 34 VAL HG12 H 1 0.831 0.046 . . . . . A 34 VAL HG12 . 25855 1 113 . 1 1 34 34 VAL HG13 H 1 0.831 0.046 . . . . . A 34 VAL HG13 . 25855 1 114 . 1 1 34 34 VAL HG21 H 1 0.519 0.011 . . . . . A 34 VAL HG21 . 25855 1 115 . 1 1 34 34 VAL HG22 H 1 0.519 0.011 . . . . . A 34 VAL HG22 . 25855 1 116 . 1 1 34 34 VAL HG23 H 1 0.519 0.011 . . . . . A 34 VAL HG23 . 25855 1 117 . 1 1 34 34 VAL CA C 13 67.342 0.127 . . . . . A 34 VAL CA . 25855 1 118 . 1 1 34 34 VAL CB C 13 31.522 0.153 . . . . . A 34 VAL CB . 25855 1 119 . 1 1 34 34 VAL CG1 C 13 23.774 0.000 . . . . . A 34 VAL CG1 . 25855 1 120 . 1 1 34 34 VAL CG2 C 13 22.075 0.000 . . . . . A 34 VAL CG2 . 25855 1 121 . 1 1 35 35 GLY HA2 H 1 3.132 0.001 . . . . . A 35 GLY HA2 . 25855 1 122 . 1 1 35 35 GLY HA3 H 1 3.511 0.012 . . . . . A 35 GLY HA3 . 25855 1 123 . 1 1 35 35 GLY CA C 13 46.899 0.010 . . . . . A 35 GLY CA . 25855 1 124 . 1 1 36 36 ALA HA H 1 2.993 0.000 . . . . . A 36 ALA HA . 25855 1 125 . 1 1 36 36 ALA HB1 H 1 1.252 0.015 . . . . . A 36 ALA HB1 . 25855 1 126 . 1 1 36 36 ALA HB2 H 1 1.252 0.015 . . . . . A 36 ALA HB2 . 25855 1 127 . 1 1 36 36 ALA HB3 H 1 1.252 0.015 . . . . . A 36 ALA HB3 . 25855 1 128 . 1 1 36 36 ALA CA C 13 53.238 0.000 . . . . . A 36 ALA CA . 25855 1 129 . 1 1 36 36 ALA CB C 13 18.247 0.038 . . . . . A 36 ALA CB . 25855 1 130 . 1 1 37 37 ILE HA H 1 3.451 0.010 . . . . . A 37 ILE HA . 25855 1 131 . 1 1 37 37 ILE HB H 1 1.711 0.007 . . . . . A 37 ILE HB . 25855 1 132 . 1 1 37 37 ILE HG12 H 1 1.394 0.014 . . . . . A 37 ILE HG12 . 25855 1 133 . 1 1 37 37 ILE HG13 H 1 0.935 0.008 . . . . . A 37 ILE HG13 . 25855 1 134 . 1 1 37 37 ILE HG21 H 1 0.607 0.084 . . . . . A 37 ILE HG21 . 25855 1 135 . 1 1 37 37 ILE HG22 H 1 0.607 0.084 . . . . . A 37 ILE HG22 . 25855 1 136 . 1 1 37 37 ILE HG23 H 1 0.607 0.084 . . . . . A 37 ILE HG23 . 25855 1 137 . 1 1 37 37 ILE HD11 H 1 0.483 0.030 . . . . . A 37 ILE HD11 . 25855 1 138 . 1 1 37 37 ILE HD12 H 1 0.483 0.030 . . . . . A 37 ILE HD12 . 25855 1 139 . 1 1 37 37 ILE HD13 H 1 0.483 0.030 . . . . . A 37 ILE HD13 . 25855 1 140 . 1 1 37 37 ILE CA C 13 60.517 0.198 . . . . . A 37 ILE CA . 25855 1 141 . 1 1 37 37 ILE CB C 13 35.310 0.099 . . . . . A 37 ILE CB . 25855 1 142 . 1 1 37 37 ILE CG1 C 13 27.636 0.112 . . . . . A 37 ILE CG1 . 25855 1 143 . 1 1 37 37 ILE CD1 C 13 9.742 0.053 . . . . . A 37 ILE CD1 . 25855 1 144 . 1 1 38 38 ILE HA H 1 3.889 0.000 . . . . . A 38 ILE HA . 25855 1 145 . 1 1 38 38 ILE HB H 1 1.205 0.002 . . . . . A 38 ILE HB . 25855 1 146 . 1 1 38 38 ILE HG12 H 1 1.755 0.000 . . . . . A 38 ILE HG12 . 25855 1 147 . 1 1 38 38 ILE HG13 H 1 1.202 0.000 . . . . . A 38 ILE HG13 . 25855 1 148 . 1 1 38 38 ILE HG21 H 1 0.815 0.007 . . . . . A 38 ILE HG21 . 25855 1 149 . 1 1 38 38 ILE HG22 H 1 0.815 0.007 . . . . . A 38 ILE HG22 . 25855 1 150 . 1 1 38 38 ILE HG23 H 1 0.815 0.007 . . . . . A 38 ILE HG23 . 25855 1 151 . 1 1 38 38 ILE HD11 H 1 -0.269 0.006 . . . . . A 38 ILE HD11 . 25855 1 152 . 1 1 38 38 ILE HD12 H 1 -0.269 0.006 . . . . . A 38 ILE HD12 . 25855 1 153 . 1 1 38 38 ILE HD13 H 1 -0.269 0.006 . . . . . A 38 ILE HD13 . 25855 1 154 . 1 1 38 38 ILE CA C 13 64.581 0.000 . . . . . A 38 ILE CA . 25855 1 155 . 1 1 38 38 ILE CB C 13 38.840 0.218 . . . . . A 38 ILE CB . 25855 1 156 . 1 1 38 38 ILE CG2 C 13 17.736 0.161 . . . . . A 38 ILE CG2 . 25855 1 157 . 1 1 38 38 ILE CD1 C 13 12.387 0.115 . . . . . A 38 ILE CD1 . 25855 1 158 . 1 1 39 39 GLY HA2 H 1 3.723 0.011 . . . . . A 39 GLY HA2 . 25855 1 159 . 1 1 39 39 GLY HA3 H 1 3.919 0.010 . . . . . A 39 GLY HA3 . 25855 1 160 . 1 1 39 39 GLY CA C 13 47.152 0.002 . . . . . A 39 GLY CA . 25855 1 161 . 1 1 40 40 LYS HA H 1 4.580 0.013 . . . . . A 40 LYS HA . 25855 1 162 . 1 1 40 40 LYS HB2 H 1 1.957 0.000 . . . . . A 40 LYS HB2 . 25855 1 163 . 1 1 40 40 LYS HB3 H 1 1.957 0.000 . . . . . A 40 LYS HB3 . 25855 1 164 . 1 1 40 40 LYS HG2 H 1 1.823 0.022 . . . . . A 40 LYS HG2 . 25855 1 165 . 1 1 40 40 LYS HG3 H 1 1.603 0.006 . . . . . A 40 LYS HG3 . 25855 1 166 . 1 1 40 40 LYS HE2 H 1 3.107 0.000 . . . . . A 40 LYS HE2 . 25855 1 167 . 1 1 40 40 LYS HE3 H 1 2.955 0.000 . . . . . A 40 LYS HE3 . 25855 1 168 . 1 1 40 40 LYS CA C 13 58.370 0.360 . . . . . A 40 LYS CA . 25855 1 169 . 1 1 40 40 LYS CG C 13 26.115 0.213 . . . . . A 40 LYS CG . 25855 1 170 . 1 1 41 41 LYS HB2 H 1 1.741 0.001 . . . . . A 41 LYS HB2 . 25855 1 171 . 1 1 41 41 LYS HB3 H 1 1.741 0.001 . . . . . A 41 LYS HB3 . 25855 1 172 . 1 1 41 41 LYS HE2 H 1 3.263 0.014 . . . . . A 41 LYS HE2 . 25855 1 173 . 1 1 41 41 LYS HE3 H 1 3.109 0.012 . . . . . A 41 LYS HE3 . 25855 1 174 . 1 1 41 41 LYS CB C 13 32.800 0.000 . . . . . A 41 LYS CB . 25855 1 175 . 1 1 41 41 LYS CE C 13 42.411 0.000 . . . . . A 41 LYS CE . 25855 1 176 . 1 1 42 42 GLY HA2 H 1 3.848 0.000 . . . . . A 42 GLY HA2 . 25855 1 177 . 1 1 42 42 GLY HA3 H 1 4.002 0.000 . . . . . A 42 GLY HA3 . 25855 1 178 . 1 1 44 44 HIS HA H 1 4.342 0.012 . . . . . A 44 HIS HA . 25855 1 179 . 1 1 44 44 HIS HB2 H 1 3.162 0.003 . . . . . A 44 HIS HB2 . 25855 1 180 . 1 1 44 44 HIS HB3 H 1 2.645 0.046 . . . . . A 44 HIS HB3 . 25855 1 181 . 1 1 44 44 HIS CB C 13 27.233 0.163 . . . . . A 44 HIS CB . 25855 1 182 . 1 1 45 45 ILE HA H 1 3.888 0.016 . . . . . A 45 ILE HA . 25855 1 183 . 1 1 45 45 ILE HB H 1 2.114 0.013 . . . . . A 45 ILE HB . 25855 1 184 . 1 1 45 45 ILE HG12 H 1 1.372 0.001 . . . . . A 45 ILE HG12 . 25855 1 185 . 1 1 45 45 ILE HG13 H 1 1.251 0.035 . . . . . A 45 ILE HG13 . 25855 1 186 . 1 1 45 45 ILE HG21 H 1 1.193 0.040 . . . . . A 45 ILE HG21 . 25855 1 187 . 1 1 45 45 ILE HG22 H 1 1.193 0.040 . . . . . A 45 ILE HG22 . 25855 1 188 . 1 1 45 45 ILE HG23 H 1 1.193 0.040 . . . . . A 45 ILE HG23 . 25855 1 189 . 1 1 45 45 ILE HD11 H 1 0.555 0.007 . . . . . A 45 ILE HD11 . 25855 1 190 . 1 1 45 45 ILE HD12 H 1 0.555 0.007 . . . . . A 45 ILE HD12 . 25855 1 191 . 1 1 45 45 ILE HD13 H 1 0.555 0.007 . . . . . A 45 ILE HD13 . 25855 1 192 . 1 1 45 45 ILE CA C 13 64.638 0.378 . . . . . A 45 ILE CA . 25855 1 193 . 1 1 45 45 ILE CB C 13 37.250 0.286 . . . . . A 45 ILE CB . 25855 1 194 . 1 1 45 45 ILE CG1 C 13 29.751 0.000 . . . . . A 45 ILE CG1 . 25855 1 195 . 1 1 45 45 ILE CG2 C 13 17.929 0.208 . . . . . A 45 ILE CG2 . 25855 1 196 . 1 1 45 45 ILE CD1 C 13 14.452 0.164 . . . . . A 45 ILE CD1 . 25855 1 197 . 1 1 46 46 LYS HA H 1 4.136 0.012 . . . . . A 46 LYS HA . 25855 1 198 . 1 1 46 46 LYS HB2 H 1 1.842 0.014 . . . . . A 46 LYS HB2 . 25855 1 199 . 1 1 46 46 LYS HB3 H 1 1.842 0.014 . . . . . A 46 LYS HB3 . 25855 1 200 . 1 1 46 46 LYS HG2 H 1 1.483 0.007 . . . . . A 46 LYS HG2 . 25855 1 201 . 1 1 46 46 LYS HG3 H 1 1.483 0.007 . . . . . A 46 LYS HG3 . 25855 1 202 . 1 1 46 46 LYS HD2 H 1 1.778 0.000 . . . . . A 46 LYS HD2 . 25855 1 203 . 1 1 46 46 LYS HD3 H 1 1.778 0.000 . . . . . A 46 LYS HD3 . 25855 1 204 . 1 1 46 46 LYS HE2 H 1 2.908 0.041 . . . . . A 46 LYS HE2 . 25855 1 205 . 1 1 46 46 LYS HE3 H 1 2.908 0.041 . . . . . A 46 LYS HE3 . 25855 1 206 . 1 1 46 46 LYS CA C 13 59.603 0.019 . . . . . A 46 LYS CA . 25855 1 207 . 1 1 46 46 LYS CB C 13 32.470 0.098 . . . . . A 46 LYS CB . 25855 1 208 . 1 1 46 46 LYS CD C 13 29.053 0.000 . . . . . A 46 LYS CD . 25855 1 209 . 1 1 46 46 LYS CE C 13 41.878 0.000 . . . . . A 46 LYS CE . 25855 1 210 . 1 1 47 47 GLN HA H 1 4.034 0.000 . . . . . A 47 GLN HA . 25855 1 211 . 1 1 48 48 LEU HA H 1 4.042 0.006 . . . . . A 48 LEU HA . 25855 1 212 . 1 1 48 48 LEU HB2 H 1 1.608 0.013 . . . . . A 48 LEU HB2 . 25855 1 213 . 1 1 48 48 LEU HB3 H 1 1.391 0.007 . . . . . A 48 LEU HB3 . 25855 1 214 . 1 1 48 48 LEU HG H 1 1.674 0.097 . . . . . A 48 LEU HG . 25855 1 215 . 1 1 48 48 LEU HD11 H 1 0.795 0.022 . . . . . A 48 LEU HD11 . 25855 1 216 . 1 1 48 48 LEU HD12 H 1 0.795 0.022 . . . . . A 48 LEU HD12 . 25855 1 217 . 1 1 48 48 LEU HD13 H 1 0.795 0.022 . . . . . A 48 LEU HD13 . 25855 1 218 . 1 1 48 48 LEU HD21 H 1 0.657 0.001 . . . . . A 48 LEU HD21 . 25855 1 219 . 1 1 48 48 LEU HD22 H 1 0.657 0.001 . . . . . A 48 LEU HD22 . 25855 1 220 . 1 1 48 48 LEU HD23 H 1 0.657 0.001 . . . . . A 48 LEU HD23 . 25855 1 221 . 1 1 48 48 LEU CA C 13 58.085 0.226 . . . . . A 48 LEU CA . 25855 1 222 . 1 1 48 48 LEU CB C 13 42.371 0.457 . . . . . A 48 LEU CB . 25855 1 223 . 1 1 48 48 LEU CD1 C 13 24.584 0.154 . . . . . A 48 LEU CD1 . 25855 1 224 . 1 1 49 49 SER HA H 1 4.183 0.011 . . . . . A 49 SER HA . 25855 1 225 . 1 1 49 49 SER CA C 13 61.932 0.061 . . . . . A 49 SER CA . 25855 1 226 . 1 1 50 50 ARG HA H 1 4.159 0.004 . . . . . A 50 ARG HA . 25855 1 227 . 1 1 50 50 ARG HB2 H 1 1.935 0.007 . . . . . A 50 ARG HB2 . 25855 1 228 . 1 1 50 50 ARG HB3 H 1 1.935 0.007 . . . . . A 50 ARG HB3 . 25855 1 229 . 1 1 50 50 ARG HG2 H 1 1.773 0.007 . . . . . A 50 ARG HG2 . 25855 1 230 . 1 1 50 50 ARG HG3 H 1 1.679 0.002 . . . . . A 50 ARG HG3 . 25855 1 231 . 1 1 50 50 ARG HD2 H 1 3.208 0.008 . . . . . A 50 ARG HD2 . 25855 1 232 . 1 1 50 50 ARG HD3 H 1 3.208 0.008 . . . . . A 50 ARG HD3 . 25855 1 233 . 1 1 50 50 ARG CA C 13 58.431 0.000 . . . . . A 50 ARG CA . 25855 1 234 . 1 1 50 50 ARG CB C 13 30.152 0.061 . . . . . A 50 ARG CB . 25855 1 235 . 1 1 50 50 ARG CG C 13 27.536 0.441 . . . . . A 50 ARG CG . 25855 1 236 . 1 1 50 50 ARG CD C 13 43.179 0.047 . . . . . A 50 ARG CD . 25855 1 237 . 1 1 51 51 PHE HA H 1 4.322 0.006 . . . . . A 51 PHE HA . 25855 1 238 . 1 1 51 51 PHE HB2 H 1 3.388 0.011 . . . . . A 51 PHE HB2 . 25855 1 239 . 1 1 51 51 PHE HB3 H 1 3.072 0.005 . . . . . A 51 PHE HB3 . 25855 1 240 . 1 1 51 51 PHE HD1 H 1 7.141 0.052 . . . . . A 51 PHE HD1 . 25855 1 241 . 1 1 51 51 PHE HD2 H 1 7.141 0.052 . . . . . A 51 PHE HD2 . 25855 1 242 . 1 1 51 51 PHE HE1 H 1 7.250 0.007 . . . . . A 51 PHE HE1 . 25855 1 243 . 1 1 51 51 PHE HE2 H 1 7.250 0.007 . . . . . A 51 PHE HE2 . 25855 1 244 . 1 1 51 51 PHE CA C 13 59.819 0.129 . . . . . A 51 PHE CA . 25855 1 245 . 1 1 51 51 PHE CB C 13 39.525 0.107 . . . . . A 51 PHE CB . 25855 1 246 . 1 1 52 52 ALA H H 1 8.465 0.000 . . . . . A 52 ALA H . 25855 1 247 . 1 1 52 52 ALA HA H 1 3.763 0.003 . . . . . A 52 ALA HA . 25855 1 248 . 1 1 52 52 ALA HB1 H 1 1.378 0.013 . . . . . A 52 ALA HB1 . 25855 1 249 . 1 1 52 52 ALA HB2 H 1 1.378 0.013 . . . . . A 52 ALA HB2 . 25855 1 250 . 1 1 52 52 ALA HB3 H 1 1.378 0.013 . . . . . A 52 ALA HB3 . 25855 1 251 . 1 1 52 52 ALA CA C 13 52.378 0.000 . . . . . A 52 ALA CA . 25855 1 252 . 1 1 52 52 ALA CB C 13 19.378 0.502 . . . . . A 52 ALA CB . 25855 1 253 . 1 1 53 53 SER HB2 H 1 4.134 0.005 . . . . . A 53 SER HB2 . 25855 1 254 . 1 1 53 53 SER HB3 H 1 3.999 0.011 . . . . . A 53 SER HB3 . 25855 1 255 . 1 1 53 53 SER CB C 13 61.826 0.175 . . . . . A 53 SER CB . 25855 1 256 . 1 1 54 54 ALA HA H 1 4.932 0.005 . . . . . A 54 ALA HA . 25855 1 257 . 1 1 54 54 ALA HB1 H 1 0.994 0.005 . . . . . A 54 ALA HB1 . 25855 1 258 . 1 1 54 54 ALA HB2 H 1 0.994 0.005 . . . . . A 54 ALA HB2 . 25855 1 259 . 1 1 54 54 ALA HB3 H 1 0.994 0.005 . . . . . A 54 ALA HB3 . 25855 1 260 . 1 1 54 54 ALA CA C 13 49.133 0.001 . . . . . A 54 ALA CA . 25855 1 261 . 1 1 54 54 ALA CB C 13 23.398 0.112 . . . . . A 54 ALA CB . 25855 1 262 . 1 1 55 55 SER HA H 1 4.766 0.000 . . . . . A 55 SER HA . 25855 1 263 . 1 1 55 55 SER HB2 H 1 3.808 0.003 . . . . . A 55 SER HB2 . 25855 1 264 . 1 1 55 55 SER HB3 H 1 3.808 0.003 . . . . . A 55 SER HB3 . 25855 1 265 . 1 1 55 55 SER CB C 13 63.541 0.108 . . . . . A 55 SER CB . 25855 1 266 . 1 1 56 56 ILE HA H 1 4.992 0.009 . . . . . A 56 ILE HA . 25855 1 267 . 1 1 56 56 ILE HB H 1 1.552 0.023 . . . . . A 56 ILE HB . 25855 1 268 . 1 1 56 56 ILE HG12 H 1 1.435 0.049 . . . . . A 56 ILE HG12 . 25855 1 269 . 1 1 56 56 ILE HG13 H 1 0.823 0.052 . . . . . A 56 ILE HG13 . 25855 1 270 . 1 1 56 56 ILE HG21 H 1 0.873 0.137 . . . . . A 56 ILE HG21 . 25855 1 271 . 1 1 56 56 ILE HG22 H 1 0.873 0.137 . . . . . A 56 ILE HG22 . 25855 1 272 . 1 1 56 56 ILE HG23 H 1 0.873 0.137 . . . . . A 56 ILE HG23 . 25855 1 273 . 1 1 56 56 ILE HD11 H 1 0.639 0.044 . . . . . A 56 ILE HD11 . 25855 1 274 . 1 1 56 56 ILE HD12 H 1 0.639 0.044 . . . . . A 56 ILE HD12 . 25855 1 275 . 1 1 56 56 ILE HD13 H 1 0.639 0.044 . . . . . A 56 ILE HD13 . 25855 1 276 . 1 1 56 56 ILE CA C 13 60.191 0.122 . . . . . A 56 ILE CA . 25855 1 277 . 1 1 56 56 ILE CB C 13 40.511 0.111 . . . . . A 56 ILE CB . 25855 1 278 . 1 1 56 56 ILE CG1 C 13 27.244 0.368 . . . . . A 56 ILE CG1 . 25855 1 279 . 1 1 56 56 ILE CG2 C 13 18.139 0.045 . . . . . A 56 ILE CG2 . 25855 1 280 . 1 1 56 56 ILE CD1 C 13 13.852 0.198 . . . . . A 56 ILE CD1 . 25855 1 281 . 1 1 57 57 LYS H H 1 8.732 0.000 . . . . . A 57 LYS H . 25855 1 282 . 1 1 57 57 LYS HA H 1 4.754 0.009 . . . . . A 57 LYS HA . 25855 1 283 . 1 1 57 57 LYS HB2 H 1 1.806 0.009 . . . . . A 57 LYS HB2 . 25855 1 284 . 1 1 57 57 LYS HB3 H 1 1.704 0.017 . . . . . A 57 LYS HB3 . 25855 1 285 . 1 1 57 57 LYS HG2 H 1 1.317 0.060 . . . . . A 57 LYS HG2 . 25855 1 286 . 1 1 57 57 LYS HG3 H 1 1.317 0.060 . . . . . A 57 LYS HG3 . 25855 1 287 . 1 1 57 57 LYS HD2 H 1 1.647 0.007 . . . . . A 57 LYS HD2 . 25855 1 288 . 1 1 57 57 LYS HD3 H 1 1.647 0.007 . . . . . A 57 LYS HD3 . 25855 1 289 . 1 1 57 57 LYS HE2 H 1 2.921 0.015 . . . . . A 57 LYS HE2 . 25855 1 290 . 1 1 57 57 LYS HE3 H 1 2.921 0.015 . . . . . A 57 LYS HE3 . 25855 1 291 . 1 1 57 57 LYS CA C 13 54.655 0.233 . . . . . A 57 LYS CA . 25855 1 292 . 1 1 57 57 LYS CB C 13 36.326 0.021 . . . . . A 57 LYS CB . 25855 1 293 . 1 1 57 57 LYS CG C 13 24.706 0.000 . . . . . A 57 LYS CG . 25855 1 294 . 1 1 57 57 LYS CD C 13 28.925 0.051 . . . . . A 57 LYS CD . 25855 1 295 . 1 1 57 57 LYS CE C 13 41.837 0.137 . . . . . A 57 LYS CE . 25855 1 296 . 1 1 58 58 ILE HA H 1 4.711 0.012 . . . . . A 58 ILE HA . 25855 1 297 . 1 1 58 58 ILE HB H 1 1.757 0.025 . . . . . A 58 ILE HB . 25855 1 298 . 1 1 58 58 ILE HG12 H 1 1.121 0.016 . . . . . A 58 ILE HG12 . 25855 1 299 . 1 1 58 58 ILE HG13 H 1 0.824 0.072 . . . . . A 58 ILE HG13 . 25855 1 300 . 1 1 58 58 ILE HG21 H 1 0.666 0.064 . . . . . A 58 ILE HG21 . 25855 1 301 . 1 1 58 58 ILE HG22 H 1 0.666 0.064 . . . . . A 58 ILE HG22 . 25855 1 302 . 1 1 58 58 ILE HG23 H 1 0.666 0.064 . . . . . A 58 ILE HG23 . 25855 1 303 . 1 1 58 58 ILE HD11 H 1 0.344 0.008 . . . . . A 58 ILE HD11 . 25855 1 304 . 1 1 58 58 ILE HD12 H 1 0.344 0.008 . . . . . A 58 ILE HD12 . 25855 1 305 . 1 1 58 58 ILE HD13 H 1 0.344 0.008 . . . . . A 58 ILE HD13 . 25855 1 306 . 1 1 58 58 ILE CA C 13 60.597 0.251 . . . . . A 58 ILE CA . 25855 1 307 . 1 1 58 58 ILE CB C 13 37.464 0.000 . . . . . A 58 ILE CB . 25855 1 308 . 1 1 58 58 ILE CG1 C 13 27.647 0.397 . . . . . A 58 ILE CG1 . 25855 1 309 . 1 1 58 58 ILE CG2 C 13 17.214 0.209 . . . . . A 58 ILE CG2 . 25855 1 310 . 1 1 58 58 ILE CD1 C 13 13.140 0.222 . . . . . A 58 ILE CD1 . 25855 1 311 . 1 1 59 59 ALA HA H 1 4.508 0.012 . . . . . A 59 ALA HA . 25855 1 312 . 1 1 59 59 ALA HB1 H 1 1.319 0.041 . . . . . A 59 ALA HB1 . 25855 1 313 . 1 1 59 59 ALA HB2 H 1 1.319 0.041 . . . . . A 59 ALA HB2 . 25855 1 314 . 1 1 59 59 ALA HB3 H 1 1.319 0.041 . . . . . A 59 ALA HB3 . 25855 1 315 . 1 1 59 59 ALA CA C 13 51.688 0.171 . . . . . A 59 ALA CA . 25855 1 316 . 1 1 59 59 ALA CB C 13 18.359 0.000 . . . . . A 59 ALA CB . 25855 1 317 . 1 1 60 60 PRO HD2 H 1 3.685 0.002 . . . . . A 60 PRO HD2 . 25855 1 318 . 1 1 60 60 PRO HD3 H 1 3.557 0.024 . . . . . A 60 PRO HD3 . 25855 1 319 . 1 1 60 60 PRO CD C 13 50.382 0.079 . . . . . A 60 PRO CD . 25855 1 320 . 1 1 62 62 GLU HA H 1 4.039 0.013 . . . . . A 62 GLU HA . 25855 1 321 . 1 1 62 62 GLU HB2 H 1 2.104 0.006 . . . . . A 62 GLU HB2 . 25855 1 322 . 1 1 62 62 GLU HB3 H 1 2.104 0.006 . . . . . A 62 GLU HB3 . 25855 1 323 . 1 1 62 62 GLU HG2 H 1 2.328 0.032 . . . . . A 62 GLU HG2 . 25855 1 324 . 1 1 62 62 GLU HG3 H 1 2.328 0.032 . . . . . A 62 GLU HG3 . 25855 1 325 . 1 1 62 62 GLU CA C 13 58.958 0.024 . . . . . A 62 GLU CA . 25855 1 326 . 1 1 62 62 GLU CB C 13 30.430 0.222 . . . . . A 62 GLU CB . 25855 1 327 . 1 1 62 62 GLU CG C 13 34.129 0.000 . . . . . A 62 GLU CG . 25855 1 328 . 1 1 63 63 THR HA H 1 4.786 0.009 . . . . . A 63 THR HA . 25855 1 329 . 1 1 63 63 THR HB H 1 4.397 0.011 . . . . . A 63 THR HB . 25855 1 330 . 1 1 63 63 THR HG21 H 1 1.194 0.010 . . . . . A 63 THR HG21 . 25855 1 331 . 1 1 63 63 THR HG22 H 1 1.194 0.010 . . . . . A 63 THR HG22 . 25855 1 332 . 1 1 63 63 THR HG23 H 1 1.194 0.010 . . . . . A 63 THR HG23 . 25855 1 333 . 1 1 63 63 THR CA C 13 58.498 0.265 . . . . . A 63 THR CA . 25855 1 334 . 1 1 63 63 THR CB C 13 69.943 0.017 . . . . . A 63 THR CB . 25855 1 335 . 1 1 63 63 THR CG2 C 13 22.117 0.134 . . . . . A 63 THR CG2 . 25855 1 336 . 1 1 64 64 PRO HA H 1 4.289 0.001 . . . . . A 64 PRO HA . 25855 1 337 . 1 1 64 64 PRO HB2 H 1 2.339 0.012 . . . . . A 64 PRO HB2 . 25855 1 338 . 1 1 64 64 PRO HB3 H 1 1.887 0.000 . . . . . A 64 PRO HB3 . 25855 1 339 . 1 1 64 64 PRO HG2 H 1 2.055 0.010 . . . . . A 64 PRO HG2 . 25855 1 340 . 1 1 64 64 PRO HG3 H 1 1.944 0.005 . . . . . A 64 PRO HG3 . 25855 1 341 . 1 1 64 64 PRO HD2 H 1 3.804 0.013 . . . . . A 64 PRO HD2 . 25855 1 342 . 1 1 64 64 PRO HD3 H 1 3.741 0.033 . . . . . A 64 PRO HD3 . 25855 1 343 . 1 1 64 64 PRO CA C 13 64.733 0.112 . . . . . A 64 PRO CA . 25855 1 344 . 1 1 64 64 PRO CB C 13 31.673 0.000 . . . . . A 64 PRO CB . 25855 1 345 . 1 1 64 64 PRO CG C 13 27.607 0.000 . . . . . A 64 PRO CG . 25855 1 346 . 1 1 64 64 PRO CD C 13 50.517 0.123 . . . . . A 64 PRO CD . 25855 1 347 . 1 1 65 65 ASP H H 1 7.985 0.000 . . . . . A 65 ASP H . 25855 1 348 . 1 1 65 65 ASP HA H 1 4.640 0.004 . . . . . A 65 ASP HA . 25855 1 349 . 1 1 65 65 ASP HB2 H 1 2.639 0.004 . . . . . A 65 ASP HB2 . 25855 1 350 . 1 1 65 65 ASP HB3 H 1 2.639 0.004 . . . . . A 65 ASP HB3 . 25855 1 351 . 1 1 65 65 ASP CA C 13 52.859 0.000 . . . . . A 65 ASP CA . 25855 1 352 . 1 1 65 65 ASP CB C 13 40.460 0.000 . . . . . A 65 ASP CB . 25855 1 353 . 1 1 66 66 SER H H 1 7.515 0.000 . . . . . A 66 SER H . 25855 1 354 . 1 1 66 66 SER HB2 H 1 4.079 0.000 . . . . . A 66 SER HB2 . 25855 1 355 . 1 1 66 66 SER HB3 H 1 4.079 0.000 . . . . . A 66 SER HB3 . 25855 1 356 . 1 1 66 66 SER CB C 13 63.942 0.000 . . . . . A 66 SER CB . 25855 1 357 . 1 1 67 67 LYS HA H 1 4.343 0.008 . . . . . A 67 LYS HA . 25855 1 358 . 1 1 67 67 LYS HB2 H 1 2.116 0.013 . . . . . A 67 LYS HB2 . 25855 1 359 . 1 1 67 67 LYS HG2 H 1 1.611 0.000 . . . . . A 67 LYS HG2 . 25855 1 360 . 1 1 67 67 LYS HG3 H 1 1.514 0.008 . . . . . A 67 LYS HG3 . 25855 1 361 . 1 1 67 67 LYS HD2 H 1 1.798 0.000 . . . . . A 67 LYS HD2 . 25855 1 362 . 1 1 67 67 LYS HD3 H 1 1.798 0.000 . . . . . A 67 LYS HD3 . 25855 1 363 . 1 1 67 67 LYS HE2 H 1 3.038 0.005 . . . . . A 67 LYS HE2 . 25855 1 364 . 1 1 67 67 LYS HE3 H 1 3.038 0.005 . . . . . A 67 LYS HE3 . 25855 1 365 . 1 1 67 67 LYS CA C 13 57.242 0.076 . . . . . A 67 LYS CA . 25855 1 366 . 1 1 67 67 LYS CB C 13 32.803 0.000 . . . . . A 67 LYS CB . 25855 1 367 . 1 1 67 67 LYS CG C 13 25.210 0.000 . . . . . A 67 LYS CG . 25855 1 368 . 1 1 67 67 LYS CE C 13 42.067 0.051 . . . . . A 67 LYS CE . 25855 1 369 . 1 1 68 68 VAL HA H 1 5.193 0.006 . . . . . A 68 VAL HA . 25855 1 370 . 1 1 68 68 VAL HB H 1 2.037 0.021 . . . . . A 68 VAL HB . 25855 1 371 . 1 1 68 68 VAL HG11 H 1 0.808 0.014 . . . . . A 68 VAL HG11 . 25855 1 372 . 1 1 68 68 VAL HG12 H 1 0.808 0.014 . . . . . A 68 VAL HG12 . 25855 1 373 . 1 1 68 68 VAL HG13 H 1 0.808 0.014 . . . . . A 68 VAL HG13 . 25855 1 374 . 1 1 68 68 VAL HG21 H 1 0.785 0.012 . . . . . A 68 VAL HG21 . 25855 1 375 . 1 1 68 68 VAL HG22 H 1 0.785 0.012 . . . . . A 68 VAL HG22 . 25855 1 376 . 1 1 68 68 VAL HG23 H 1 0.785 0.012 . . . . . A 68 VAL HG23 . 25855 1 377 . 1 1 68 68 VAL CA C 13 58.972 0.171 . . . . . A 68 VAL CA . 25855 1 378 . 1 1 68 68 VAL CB C 13 36.216 0.293 . . . . . A 68 VAL CB . 25855 1 379 . 1 1 68 68 VAL CG1 C 13 20.805 0.786 . . . . . A 68 VAL CG1 . 25855 1 380 . 1 1 68 68 VAL CG2 C 13 18.357 0.112 . . . . . A 68 VAL CG2 . 25855 1 381 . 1 1 69 69 ARG HA H 1 4.692 0.015 . . . . . A 69 ARG HA . 25855 1 382 . 1 1 69 69 ARG HB2 H 1 1.512 0.005 . . . . . A 69 ARG HB2 . 25855 1 383 . 1 1 69 69 ARG HB3 H 1 1.107 0.073 . . . . . A 69 ARG HB3 . 25855 1 384 . 1 1 69 69 ARG HG2 H 1 1.227 0.000 . . . . . A 69 ARG HG2 . 25855 1 385 . 1 1 69 69 ARG HG3 H 1 1.227 0.000 . . . . . A 69 ARG HG3 . 25855 1 386 . 1 1 69 69 ARG CA C 13 52.273 0.186 . . . . . A 69 ARG CA . 25855 1 387 . 1 1 69 69 ARG CB C 13 32.761 0.232 . . . . . A 69 ARG CB . 25855 1 388 . 1 1 70 70 MET HA H 1 3.798 0.007 . . . . . A 70 MET HA . 25855 1 389 . 1 1 70 70 MET HB2 H 1 1.799 0.016 . . . . . A 70 MET HB2 . 25855 1 390 . 1 1 70 70 MET HG3 H 1 1.014 0.001 . . . . . A 70 MET HG3 . 25855 1 391 . 1 1 70 70 MET CA C 13 55.444 0.230 . . . . . A 70 MET CA . 25855 1 392 . 1 1 70 70 MET CB C 13 36.034 0.061 . . . . . A 70 MET CB . 25855 1 393 . 1 1 70 70 MET CG C 13 30.614 0.260 . . . . . A 70 MET CG . 25855 1 394 . 1 1 71 71 VAL HA H 1 4.312 0.008 . . . . . A 71 VAL HA . 25855 1 395 . 1 1 71 71 VAL HB H 1 2.022 0.000 . . . . . A 71 VAL HB . 25855 1 396 . 1 1 71 71 VAL HG11 H 1 0.660 0.002 . . . . . A 71 VAL HG11 . 25855 1 397 . 1 1 71 71 VAL HG12 H 1 0.660 0.002 . . . . . A 71 VAL HG12 . 25855 1 398 . 1 1 71 71 VAL HG13 H 1 0.660 0.002 . . . . . A 71 VAL HG13 . 25855 1 399 . 1 1 71 71 VAL HG21 H 1 0.664 0.006 . . . . . A 71 VAL HG21 . 25855 1 400 . 1 1 71 71 VAL HG22 H 1 0.664 0.006 . . . . . A 71 VAL HG22 . 25855 1 401 . 1 1 71 71 VAL HG23 H 1 0.664 0.006 . . . . . A 71 VAL HG23 . 25855 1 402 . 1 1 71 71 VAL CA C 13 60.897 0.054 . . . . . A 71 VAL CA . 25855 1 403 . 1 1 71 71 VAL CG1 C 13 21.548 0.000 . . . . . A 71 VAL CG1 . 25855 1 404 . 1 1 71 71 VAL CG2 C 13 21.066 0.000 . . . . . A 71 VAL CG2 . 25855 1 405 . 1 1 72 72 VAL HA H 1 4.662 0.350 . . . . . A 72 VAL HA . 25855 1 406 . 1 1 72 72 VAL HB H 1 2.041 0.012 . . . . . A 72 VAL HB . 25855 1 407 . 1 1 72 72 VAL HG11 H 1 0.753 0.068 . . . . . A 72 VAL HG11 . 25855 1 408 . 1 1 72 72 VAL HG12 H 1 0.753 0.068 . . . . . A 72 VAL HG12 . 25855 1 409 . 1 1 72 72 VAL HG13 H 1 0.753 0.068 . . . . . A 72 VAL HG13 . 25855 1 410 . 1 1 72 72 VAL HG21 H 1 0.661 0.008 . . . . . A 72 VAL HG21 . 25855 1 411 . 1 1 72 72 VAL HG22 H 1 0.661 0.008 . . . . . A 72 VAL HG22 . 25855 1 412 . 1 1 72 72 VAL HG23 H 1 0.661 0.008 . . . . . A 72 VAL HG23 . 25855 1 413 . 1 1 72 72 VAL CA C 13 61.766 0.112 . . . . . A 72 VAL CA . 25855 1 414 . 1 1 72 72 VAL CB C 13 31.464 0.000 . . . . . A 72 VAL CB . 25855 1 415 . 1 1 72 72 VAL CG1 C 13 21.351 0.000 . . . . . A 72 VAL CG1 . 25855 1 416 . 1 1 72 72 VAL CG2 C 13 20.865 0.443 . . . . . A 72 VAL CG2 . 25855 1 417 . 1 1 73 73 ILE H H 1 8.981 0.003 . . . . . A 73 ILE H . 25855 1 418 . 1 1 73 73 ILE HA H 1 4.933 0.039 . . . . . A 73 ILE HA . 25855 1 419 . 1 1 73 73 ILE HB H 1 2.003 0.004 . . . . . A 73 ILE HB . 25855 1 420 . 1 1 73 73 ILE HG12 H 1 1.558 0.022 . . . . . A 73 ILE HG12 . 25855 1 421 . 1 1 73 73 ILE HG13 H 1 1.558 0.022 . . . . . A 73 ILE HG13 . 25855 1 422 . 1 1 73 73 ILE HG21 H 1 0.685 0.015 . . . . . A 73 ILE HG21 . 25855 1 423 . 1 1 73 73 ILE HG22 H 1 0.685 0.015 . . . . . A 73 ILE HG22 . 25855 1 424 . 1 1 73 73 ILE HG23 H 1 0.685 0.015 . . . . . A 73 ILE HG23 . 25855 1 425 . 1 1 73 73 ILE HD11 H 1 0.576 0.018 . . . . . A 73 ILE HD11 . 25855 1 426 . 1 1 73 73 ILE HD12 H 1 0.576 0.018 . . . . . A 73 ILE HD12 . 25855 1 427 . 1 1 73 73 ILE HD13 H 1 0.576 0.018 . . . . . A 73 ILE HD13 . 25855 1 428 . 1 1 73 73 ILE CA C 13 60.790 0.111 . . . . . A 73 ILE CA . 25855 1 429 . 1 1 73 73 ILE CB C 13 40.101 0.000 . . . . . A 73 ILE CB . 25855 1 430 . 1 1 73 73 ILE CG1 C 13 28.330 0.000 . . . . . A 73 ILE CG1 . 25855 1 431 . 1 1 73 73 ILE CG2 C 13 15.635 0.424 . . . . . A 73 ILE CG2 . 25855 1 432 . 1 1 73 73 ILE CD1 C 13 17.856 0.191 . . . . . A 73 ILE CD1 . 25855 1 433 . 1 1 74 74 THR H H 1 9.227 0.005 . . . . . A 74 THR H . 25855 1 434 . 1 1 74 74 THR HA H 1 5.630 0.005 . . . . . A 74 THR HA . 25855 1 435 . 1 1 74 74 THR HB H 1 3.841 0.027 . . . . . A 74 THR HB . 25855 1 436 . 1 1 74 74 THR HG21 H 1 1.094 0.003 . . . . . A 74 THR HG21 . 25855 1 437 . 1 1 74 74 THR HG22 H 1 1.094 0.003 . . . . . A 74 THR HG22 . 25855 1 438 . 1 1 74 74 THR HG23 H 1 1.094 0.003 . . . . . A 74 THR HG23 . 25855 1 439 . 1 1 74 74 THR CA C 13 60.813 0.061 . . . . . A 74 THR CA . 25855 1 440 . 1 1 74 74 THR CB C 13 70.966 0.041 . . . . . A 74 THR CB . 25855 1 441 . 1 1 74 74 THR CG2 C 13 21.477 0.025 . . . . . A 74 THR CG2 . 25855 1 442 . 1 1 75 75 GLY HA2 H 1 4.037 0.008 . . . . . A 75 GLY HA2 . 25855 1 443 . 1 1 75 75 GLY HA3 H 1 4.386 0.029 . . . . . A 75 GLY HA3 . 25855 1 444 . 1 1 75 75 GLY CA C 13 45.032 0.289 . . . . . A 75 GLY CA . 25855 1 445 . 1 1 76 76 PRO HA H 1 5.169 0.014 . . . . . A 76 PRO HA . 25855 1 446 . 1 1 76 76 PRO HB2 H 1 2.463 0.002 . . . . . A 76 PRO HB2 . 25855 1 447 . 1 1 76 76 PRO HB3 H 1 2.323 0.011 . . . . . A 76 PRO HB3 . 25855 1 448 . 1 1 76 76 PRO HG2 H 1 2.190 0.008 . . . . . A 76 PRO HG2 . 25855 1 449 . 1 1 76 76 PRO HG3 H 1 1.975 0.051 . . . . . A 76 PRO HG3 . 25855 1 450 . 1 1 76 76 PRO HD2 H 1 3.598 0.012 . . . . . A 76 PRO HD2 . 25855 1 451 . 1 1 76 76 PRO HD3 H 1 3.598 0.012 . . . . . A 76 PRO HD3 . 25855 1 452 . 1 1 76 76 PRO CA C 13 62.448 0.280 . . . . . A 76 PRO CA . 25855 1 453 . 1 1 76 76 PRO CB C 13 30.567 0.226 . . . . . A 76 PRO CB . 25855 1 454 . 1 1 76 76 PRO CG C 13 27.612 0.396 . . . . . A 76 PRO CG . 25855 1 455 . 1 1 76 76 PRO CD C 13 50.160 0.072 . . . . . A 76 PRO CD . 25855 1 456 . 1 1 77 77 PRO HA H 1 3.960 0.003 . . . . . A 77 PRO HA . 25855 1 457 . 1 1 77 77 PRO HB2 H 1 2.207 0.013 . . . . . A 77 PRO HB2 . 25855 1 458 . 1 1 77 77 PRO HB3 H 1 1.897 0.034 . . . . . A 77 PRO HB3 . 25855 1 459 . 1 1 77 77 PRO HG2 H 1 2.014 0.032 . . . . . A 77 PRO HG2 . 25855 1 460 . 1 1 77 77 PRO HG3 H 1 2.014 0.032 . . . . . A 77 PRO HG3 . 25855 1 461 . 1 1 77 77 PRO HD2 H 1 3.957 0.010 . . . . . A 77 PRO HD2 . 25855 1 462 . 1 1 77 77 PRO HD3 H 1 3.785 0.013 . . . . . A 77 PRO HD3 . 25855 1 463 . 1 1 77 77 PRO CA C 13 67.086 0.276 . . . . . A 77 PRO CA . 25855 1 464 . 1 1 77 77 PRO CD C 13 50.552 0.222 . . . . . A 77 PRO CD . 25855 1 465 . 1 1 78 78 GLU H H 1 9.555 0.000 . . . . . A 78 GLU H . 25855 1 466 . 1 1 78 78 GLU HA H 1 4.135 0.027 . . . . . A 78 GLU HA . 25855 1 467 . 1 1 78 78 GLU HB2 H 1 2.010 0.003 . . . . . A 78 GLU HB2 . 25855 1 468 . 1 1 78 78 GLU HB3 H 1 1.952 0.003 . . . . . A 78 GLU HB3 . 25855 1 469 . 1 1 78 78 GLU HG2 H 1 2.305 0.003 . . . . . A 78 GLU HG2 . 25855 1 470 . 1 1 78 78 GLU HG3 H 1 2.305 0.003 . . . . . A 78 GLU HG3 . 25855 1 471 . 1 1 78 78 GLU CA C 13 59.899 0.191 . . . . . A 78 GLU CA . 25855 1 472 . 1 1 78 78 GLU CB C 13 29.030 0.000 . . . . . A 78 GLU CB . 25855 1 473 . 1 1 78 78 GLU CG C 13 36.343 0.000 . . . . . A 78 GLU CG . 25855 1 474 . 1 1 79 79 ALA H H 1 7.018 0.000 . . . . . A 79 ALA H . 25855 1 475 . 1 1 79 79 ALA HA H 1 4.369 0.007 . . . . . A 79 ALA HA . 25855 1 476 . 1 1 79 79 ALA HB1 H 1 1.422 0.023 . . . . . A 79 ALA HB1 . 25855 1 477 . 1 1 79 79 ALA HB2 H 1 1.422 0.023 . . . . . A 79 ALA HB2 . 25855 1 478 . 1 1 79 79 ALA HB3 H 1 1.422 0.023 . . . . . A 79 ALA HB3 . 25855 1 479 . 1 1 79 79 ALA CA C 13 54.273 0.000 . . . . . A 79 ALA CA . 25855 1 480 . 1 1 79 79 ALA CB C 13 20.129 0.091 . . . . . A 79 ALA CB . 25855 1 481 . 1 1 80 80 GLN HA H 1 3.782 0.002 . . . . . A 80 GLN HA . 25855 1 482 . 1 1 80 80 GLN HB2 H 1 2.193 0.000 . . . . . A 80 GLN HB2 . 25855 1 483 . 1 1 80 80 GLN HB3 H 1 2.193 0.000 . . . . . A 80 GLN HB3 . 25855 1 484 . 1 1 80 80 GLN HG2 H 1 2.547 0.000 . . . . . A 80 GLN HG2 . 25855 1 485 . 1 1 80 80 GLN HG3 H 1 2.547 0.000 . . . . . A 80 GLN HG3 . 25855 1 486 . 1 1 80 80 GLN HE21 H 1 6.333 0.000 . . . . . A 80 GLN HE21 . 25855 1 487 . 1 1 80 80 GLN CA C 13 58.141 0.552 . . . . . A 80 GLN CA . 25855 1 488 . 1 1 81 81 PHE H H 1 8.005 0.000 . . . . . A 81 PHE H . 25855 1 489 . 1 1 81 81 PHE HA H 1 4.104 0.039 . . . . . A 81 PHE HA . 25855 1 490 . 1 1 81 81 PHE HB2 H 1 3.230 0.013 . . . . . A 81 PHE HB2 . 25855 1 491 . 1 1 81 81 PHE HB3 H 1 3.148 0.011 . . . . . A 81 PHE HB3 . 25855 1 492 . 1 1 81 81 PHE HD1 H 1 7.201 0.015 . . . . . A 81 PHE HD1 . 25855 1 493 . 1 1 81 81 PHE HD2 H 1 7.201 0.015 . . . . . A 81 PHE HD2 . 25855 1 494 . 1 1 81 81 PHE CA C 13 61.409 0.000 . . . . . A 81 PHE CA . 25855 1 495 . 1 1 81 81 PHE CB C 13 39.530 0.132 . . . . . A 81 PHE CB . 25855 1 496 . 1 1 82 82 LYS HA H 1 3.997 0.004 . . . . . A 82 LYS HA . 25855 1 497 . 1 1 82 82 LYS HB2 H 1 1.852 0.047 . . . . . A 82 LYS HB2 . 25855 1 498 . 1 1 82 82 LYS HB3 H 1 1.620 0.022 . . . . . A 82 LYS HB3 . 25855 1 499 . 1 1 82 82 LYS HG2 H 1 1.821 0.008 . . . . . A 82 LYS HG2 . 25855 1 500 . 1 1 82 82 LYS HG3 H 1 1.468 0.003 . . . . . A 82 LYS HG3 . 25855 1 501 . 1 1 82 82 LYS HD2 H 1 1.378 0.023 . . . . . A 82 LYS HD2 . 25855 1 502 . 1 1 82 82 LYS HD3 H 1 1.187 0.016 . . . . . A 82 LYS HD3 . 25855 1 503 . 1 1 82 82 LYS HE2 H 1 2.689 0.005 . . . . . A 82 LYS HE2 . 25855 1 504 . 1 1 82 82 LYS HE3 H 1 2.689 0.005 . . . . . A 82 LYS HE3 . 25855 1 505 . 1 1 82 82 LYS CA C 13 60.011 0.102 . . . . . A 82 LYS CA . 25855 1 506 . 1 1 82 82 LYS CG C 13 26.751 0.169 . . . . . A 82 LYS CG . 25855 1 507 . 1 1 82 82 LYS CD C 13 29.809 0.215 . . . . . A 82 LYS CD . 25855 1 508 . 1 1 82 82 LYS CE C 13 41.441 0.312 . . . . . A 82 LYS CE . 25855 1 509 . 1 1 83 83 ALA HA H 1 3.937 0.017 . . . . . A 83 ALA HA . 25855 1 510 . 1 1 83 83 ALA HB1 H 1 1.185 0.010 . . . . . A 83 ALA HB1 . 25855 1 511 . 1 1 83 83 ALA HB2 H 1 1.185 0.010 . . . . . A 83 ALA HB2 . 25855 1 512 . 1 1 83 83 ALA HB3 H 1 1.185 0.010 . . . . . A 83 ALA HB3 . 25855 1 513 . 1 1 83 83 ALA CA C 13 55.239 0.000 . . . . . A 83 ALA CA . 25855 1 514 . 1 1 83 83 ALA CB C 13 19.027 0.000 . . . . . A 83 ALA CB . 25855 1 515 . 1 1 84 84 GLN HG2 H 1 2.772 0.000 . . . . . A 84 GLN HG2 . 25855 1 516 . 1 1 84 84 GLN HG3 H 1 2.772 0.000 . . . . . A 84 GLN HG3 . 25855 1 517 . 1 1 85 85 GLY HA2 H 1 2.173 0.000 . . . . . A 85 GLY HA2 . 25855 1 518 . 1 1 85 85 GLY HA3 H 1 3.198 0.000 . . . . . A 85 GLY HA3 . 25855 1 519 . 1 1 85 85 GLY CA C 13 47.426 0.000 . . . . . A 85 GLY CA . 25855 1 520 . 1 1 86 86 ARG HA H 1 4.155 0.011 . . . . . A 86 ARG HA . 25855 1 521 . 1 1 86 86 ARG HB2 H 1 1.919 0.027 . . . . . A 86 ARG HB2 . 25855 1 522 . 1 1 86 86 ARG HB3 H 1 1.919 0.027 . . . . . A 86 ARG HB3 . 25855 1 523 . 1 1 86 86 ARG HG2 H 1 1.717 0.000 . . . . . A 86 ARG HG2 . 25855 1 524 . 1 1 86 86 ARG HG3 H 1 1.505 0.007 . . . . . A 86 ARG HG3 . 25855 1 525 . 1 1 86 86 ARG HD2 H 1 3.025 0.032 . . . . . A 86 ARG HD2 . 25855 1 526 . 1 1 86 86 ARG HD3 H 1 3.025 0.032 . . . . . A 86 ARG HD3 . 25855 1 527 . 1 1 86 86 ARG CA C 13 57.053 0.000 . . . . . A 86 ARG CA . 25855 1 528 . 1 1 86 86 ARG CB C 13 30.173 0.000 . . . . . A 86 ARG CB . 25855 1 529 . 1 1 86 86 ARG CG C 13 25.081 0.099 . . . . . A 86 ARG CG . 25855 1 530 . 1 1 86 86 ARG CD C 13 41.807 0.000 . . . . . A 86 ARG CD . 25855 1 531 . 1 1 87 87 ILE H H 1 7.681 0.003 . . . . . A 87 ILE H . 25855 1 532 . 1 1 87 87 ILE HA H 1 3.484 0.013 . . . . . A 87 ILE HA . 25855 1 533 . 1 1 87 87 ILE HB H 1 1.974 0.007 . . . . . A 87 ILE HB . 25855 1 534 . 1 1 87 87 ILE HG12 H 1 1.704 0.000 . . . . . A 87 ILE HG12 . 25855 1 535 . 1 1 87 87 ILE HG21 H 1 0.617 0.008 . . . . . A 87 ILE HG21 . 25855 1 536 . 1 1 87 87 ILE HG22 H 1 0.617 0.008 . . . . . A 87 ILE HG22 . 25855 1 537 . 1 1 87 87 ILE HG23 H 1 0.617 0.008 . . . . . A 87 ILE HG23 . 25855 1 538 . 1 1 87 87 ILE HD11 H 1 0.542 0.009 . . . . . A 87 ILE HD11 . 25855 1 539 . 1 1 87 87 ILE HD12 H 1 0.542 0.009 . . . . . A 87 ILE HD12 . 25855 1 540 . 1 1 87 87 ILE HD13 H 1 0.542 0.009 . . . . . A 87 ILE HD13 . 25855 1 541 . 1 1 87 87 ILE CA C 13 65.702 0.192 . . . . . A 87 ILE CA . 25855 1 542 . 1 1 87 87 ILE CB C 13 37.382 0.118 . . . . . A 87 ILE CB . 25855 1 543 . 1 1 87 87 ILE CG2 C 13 13.434 0.143 . . . . . A 87 ILE CG2 . 25855 1 544 . 1 1 87 87 ILE CD1 C 13 17.195 0.314 . . . . . A 87 ILE CD1 . 25855 1 545 . 1 1 88 88 TYR H H 1 8.021 0.005 . . . . . A 88 TYR H . 25855 1 546 . 1 1 88 88 TYR HA H 1 3.798 0.007 . . . . . A 88 TYR HA . 25855 1 547 . 1 1 88 88 TYR HB2 H 1 2.843 0.013 . . . . . A 88 TYR HB2 . 25855 1 548 . 1 1 88 88 TYR HB3 H 1 2.751 0.009 . . . . . A 88 TYR HB3 . 25855 1 549 . 1 1 88 88 TYR HD1 H 1 7.352 0.026 . . . . . A 88 TYR HD1 . 25855 1 550 . 1 1 88 88 TYR HD2 H 1 7.352 0.026 . . . . . A 88 TYR HD2 . 25855 1 551 . 1 1 88 88 TYR HE1 H 1 7.073 0.012 . . . . . A 88 TYR HE1 . 25855 1 552 . 1 1 88 88 TYR HE2 H 1 7.073 0.012 . . . . . A 88 TYR HE2 . 25855 1 553 . 1 1 88 88 TYR CA C 13 62.987 0.216 . . . . . A 88 TYR CA . 25855 1 554 . 1 1 88 88 TYR CB C 13 38.104 0.173 . . . . . A 88 TYR CB . 25855 1 555 . 1 1 89 89 GLY H H 1 8.005 0.002 . . . . . A 89 GLY H . 25855 1 556 . 1 1 89 89 GLY HA2 H 1 3.795 0.006 . . . . . A 89 GLY HA2 . 25855 1 557 . 1 1 89 89 GLY HA3 H 1 3.795 0.006 . . . . . A 89 GLY HA3 . 25855 1 558 . 1 1 90 90 LYS HA H 1 4.177 0.012 . . . . . A 90 LYS HA . 25855 1 559 . 1 1 90 90 LYS HB2 H 1 1.951 0.020 . . . . . A 90 LYS HB2 . 25855 1 560 . 1 1 90 90 LYS HB3 H 1 1.951 0.020 . . . . . A 90 LYS HB3 . 25855 1 561 . 1 1 90 90 LYS HG2 H 1 1.087 0.007 . . . . . A 90 LYS HG2 . 25855 1 562 . 1 1 90 90 LYS HG3 H 1 1.087 0.007 . . . . . A 90 LYS HG3 . 25855 1 563 . 1 1 90 90 LYS HD2 H 1 1.493 0.007 . . . . . A 90 LYS HD2 . 25855 1 564 . 1 1 90 90 LYS HD3 H 1 1.493 0.007 . . . . . A 90 LYS HD3 . 25855 1 565 . 1 1 90 90 LYS HE2 H 1 2.266 0.046 . . . . . A 90 LYS HE2 . 25855 1 566 . 1 1 90 90 LYS HE3 H 1 2.266 0.046 . . . . . A 90 LYS HE3 . 25855 1 567 . 1 1 90 90 LYS CA C 13 57.418 0.113 . . . . . A 90 LYS CA . 25855 1 568 . 1 1 90 90 LYS CB C 13 31.390 0.222 . . . . . A 90 LYS CB . 25855 1 569 . 1 1 90 90 LYS CD C 13 27.745 0.000 . . . . . A 90 LYS CD . 25855 1 570 . 1 1 91 91 LEU H H 1 7.545 0.000 . . . . . A 91 LEU H . 25855 1 571 . 1 1 91 91 LEU HA H 1 4.138 0.010 . . . . . A 91 LEU HA . 25855 1 572 . 1 1 91 91 LEU HB3 H 1 1.516 0.030 . . . . . A 91 LEU HB3 . 25855 1 573 . 1 1 91 91 LEU HG H 1 2.003 0.003 . . . . . A 91 LEU HG . 25855 1 574 . 1 1 91 91 LEU HD11 H 1 0.749 0.008 . . . . . A 91 LEU HD11 . 25855 1 575 . 1 1 91 91 LEU HD12 H 1 0.749 0.008 . . . . . A 91 LEU HD12 . 25855 1 576 . 1 1 91 91 LEU HD13 H 1 0.749 0.008 . . . . . A 91 LEU HD13 . 25855 1 577 . 1 1 91 91 LEU HD21 H 1 0.527 0.066 . . . . . A 91 LEU HD21 . 25855 1 578 . 1 1 91 91 LEU HD22 H 1 0.527 0.066 . . . . . A 91 LEU HD22 . 25855 1 579 . 1 1 91 91 LEU HD23 H 1 0.527 0.066 . . . . . A 91 LEU HD23 . 25855 1 580 . 1 1 91 91 LEU CA C 13 57.805 0.043 . . . . . A 91 LEU CA . 25855 1 581 . 1 1 91 91 LEU CB C 13 40.733 0.039 . . . . . A 91 LEU CB . 25855 1 582 . 1 1 91 91 LEU CG C 13 27.767 0.440 . . . . . A 91 LEU CG . 25855 1 583 . 1 1 91 91 LEU CD2 C 13 23.567 0.387 . . . . . A 91 LEU CD2 . 25855 1 584 . 1 1 92 92 LYS HA H 1 4.316 0.020 . . . . . A 92 LYS HA . 25855 1 585 . 1 1 92 92 LYS HB2 H 1 2.165 0.005 . . . . . A 92 LYS HB2 . 25855 1 586 . 1 1 92 92 LYS HB3 H 1 1.931 0.012 . . . . . A 92 LYS HB3 . 25855 1 587 . 1 1 92 92 LYS HG2 H 1 1.506 0.012 . . . . . A 92 LYS HG2 . 25855 1 588 . 1 1 92 92 LYS HG3 H 1 1.506 0.012 . . . . . A 92 LYS HG3 . 25855 1 589 . 1 1 92 92 LYS HD2 H 1 1.693 0.010 . . . . . A 92 LYS HD2 . 25855 1 590 . 1 1 92 92 LYS HD3 H 1 1.693 0.010 . . . . . A 92 LYS HD3 . 25855 1 591 . 1 1 92 92 LYS HE2 H 1 2.986 0.014 . . . . . A 92 LYS HE2 . 25855 1 592 . 1 1 92 92 LYS HE3 H 1 2.986 0.014 . . . . . A 92 LYS HE3 . 25855 1 593 . 1 1 92 92 LYS CA C 13 58.765 0.000 . . . . . A 92 LYS CA . 25855 1 594 . 1 1 92 92 LYS CB C 13 32.134 0.287 . . . . . A 92 LYS CB . 25855 1 595 . 1 1 92 92 LYS CG C 13 24.851 0.069 . . . . . A 92 LYS CG . 25855 1 596 . 1 1 92 92 LYS CD C 13 28.722 0.108 . . . . . A 92 LYS CD . 25855 1 597 . 1 1 92 92 LYS CE C 13 41.864 0.000 . . . . . A 92 LYS CE . 25855 1 598 . 1 1 93 93 GLU HA H 1 4.085 0.061 . . . . . A 93 GLU HA . 25855 1 599 . 1 1 93 93 GLU HB2 H 1 2.191 0.000 . . . . . A 93 GLU HB2 . 25855 1 600 . 1 1 93 93 GLU HB3 H 1 2.097 0.000 . . . . . A 93 GLU HB3 . 25855 1 601 . 1 1 93 93 GLU HG2 H 1 2.299 0.005 . . . . . A 93 GLU HG2 . 25855 1 602 . 1 1 93 93 GLU HG3 H 1 2.299 0.005 . . . . . A 93 GLU HG3 . 25855 1 603 . 1 1 93 93 GLU CB C 13 29.938 0.000 . . . . . A 93 GLU CB . 25855 1 604 . 1 1 93 93 GLU CG C 13 36.172 0.189 . . . . . A 93 GLU CG . 25855 1 605 . 1 1 94 94 GLU HA H 1 4.259 0.011 . . . . . A 94 GLU HA . 25855 1 606 . 1 1 94 94 GLU HB2 H 1 2.313 0.008 . . . . . A 94 GLU HB2 . 25855 1 607 . 1 1 94 94 GLU HB3 H 1 1.668 0.000 . . . . . A 94 GLU HB3 . 25855 1 608 . 1 1 94 94 GLU HG2 H 1 2.101 0.000 . . . . . A 94 GLU HG2 . 25855 1 609 . 1 1 94 94 GLU HG3 H 1 2.101 0.000 . . . . . A 94 GLU HG3 . 25855 1 610 . 1 1 94 94 GLU CA C 13 55.394 0.000 . . . . . A 94 GLU CA . 25855 1 611 . 1 1 94 94 GLU CB C 13 29.535 0.000 . . . . . A 94 GLU CB . 25855 1 612 . 1 1 95 95 ASN HA H 1 4.508 0.010 . . . . . A 95 ASN HA . 25855 1 613 . 1 1 95 95 ASN HB2 H 1 2.887 0.009 . . . . . A 95 ASN HB2 . 25855 1 614 . 1 1 95 95 ASN HB3 H 1 2.674 0.004 . . . . . A 95 ASN HB3 . 25855 1 615 . 1 1 95 95 ASN CA C 13 55.499 0.247 . . . . . A 95 ASN CA . 25855 1 616 . 1 1 95 95 ASN CB C 13 37.054 0.341 . . . . . A 95 ASN CB . 25855 1 617 . 1 1 96 96 PHE HA H 1 4.157 0.021 . . . . . A 96 PHE HA . 25855 1 618 . 1 1 96 96 PHE HB2 H 1 2.787 0.003 . . . . . A 96 PHE HB2 . 25855 1 619 . 1 1 96 96 PHE HB3 H 1 2.787 0.003 . . . . . A 96 PHE HB3 . 25855 1 620 . 1 1 96 96 PHE HD1 H 1 7.105 0.020 . . . . . A 96 PHE HD1 . 25855 1 621 . 1 1 96 96 PHE HD2 H 1 7.105 0.020 . . . . . A 96 PHE HD2 . 25855 1 622 . 1 1 96 96 PHE HE1 H 1 7.244 0.000 . . . . . A 96 PHE HE1 . 25855 1 623 . 1 1 96 96 PHE HE2 H 1 7.244 0.000 . . . . . A 96 PHE HE2 . 25855 1 624 . 1 1 96 96 PHE CA C 13 61.630 0.000 . . . . . A 96 PHE CA . 25855 1 625 . 1 1 96 96 PHE CB C 13 38.473 0.000 . . . . . A 96 PHE CB . 25855 1 626 . 1 1 97 97 PHE HA H 1 4.551 0.006 . . . . . A 97 PHE HA . 25855 1 627 . 1 1 97 97 PHE HB2 H 1 3.159 0.017 . . . . . A 97 PHE HB2 . 25855 1 628 . 1 1 97 97 PHE HB3 H 1 2.665 0.013 . . . . . A 97 PHE HB3 . 25855 1 629 . 1 1 97 97 PHE HD1 H 1 7.261 0.066 . . . . . A 97 PHE HD1 . 25855 1 630 . 1 1 97 97 PHE HD2 H 1 7.261 0.066 . . . . . A 97 PHE HD2 . 25855 1 631 . 1 1 97 97 PHE HE1 H 1 7.065 0.000 . . . . . A 97 PHE HE1 . 25855 1 632 . 1 1 97 97 PHE HE2 H 1 7.065 0.000 . . . . . A 97 PHE HE2 . 25855 1 633 . 1 1 97 97 PHE CA C 13 57.092 0.243 . . . . . A 97 PHE CA . 25855 1 634 . 1 1 97 97 PHE CB C 13 41.072 0.255 . . . . . A 97 PHE CB . 25855 1 635 . 1 1 98 98 GLY H H 1 8.539 0.003 . . . . . A 98 GLY H . 25855 1 636 . 1 1 98 98 GLY HA2 H 1 4.095 0.003 . . . . . A 98 GLY HA2 . 25855 1 637 . 1 1 98 98 GLY HA3 H 1 4.169 0.004 . . . . . A 98 GLY HA3 . 25855 1 638 . 1 1 98 98 GLY CA C 13 44.746 0.000 . . . . . A 98 GLY CA . 25855 1 639 . 1 1 99 99 PRO HA H 1 4.378 0.002 . . . . . A 99 PRO HA . 25855 1 640 . 1 1 99 99 PRO HB2 H 1 2.328 0.005 . . . . . A 99 PRO HB2 . 25855 1 641 . 1 1 99 99 PRO HB3 H 1 1.926 0.006 . . . . . A 99 PRO HB3 . 25855 1 642 . 1 1 99 99 PRO HG2 H 1 2.051 0.009 . . . . . A 99 PRO HG2 . 25855 1 643 . 1 1 99 99 PRO HG3 H 1 2.051 0.009 . . . . . A 99 PRO HG3 . 25855 1 644 . 1 1 99 99 PRO HD2 H 1 3.688 0.006 . . . . . A 99 PRO HD2 . 25855 1 645 . 1 1 99 99 PRO HD3 H 1 3.688 0.006 . . . . . A 99 PRO HD3 . 25855 1 646 . 1 1 99 99 PRO CA C 13 64.940 0.000 . . . . . A 99 PRO CA . 25855 1 647 . 1 1 99 99 PRO CB C 13 31.991 0.000 . . . . . A 99 PRO CB . 25855 1 648 . 1 1 99 99 PRO CG C 13 27.740 0.000 . . . . . A 99 PRO CG . 25855 1 649 . 1 1 99 99 PRO CD C 13 50.060 0.000 . . . . . A 99 PRO CD . 25855 1 650 . 1 1 100 100 LYS H H 1 8.622 0.083 . . . . . A 100 LYS H . 25855 1 651 . 1 1 100 100 LYS HA H 1 4.359 0.003 . . . . . A 100 LYS HA . 25855 1 652 . 1 1 100 100 LYS HB2 H 1 2.077 0.048 . . . . . A 100 LYS HB2 . 25855 1 653 . 1 1 100 100 LYS HB3 H 1 2.000 0.001 . . . . . A 100 LYS HB3 . 25855 1 654 . 1 1 100 100 LYS HG2 H 1 1.357 0.002 . . . . . A 100 LYS HG2 . 25855 1 655 . 1 1 100 100 LYS HG3 H 1 1.357 0.002 . . . . . A 100 LYS HG3 . 25855 1 656 . 1 1 100 100 LYS HD2 H 1 1.743 0.000 . . . . . A 100 LYS HD2 . 25855 1 657 . 1 1 100 100 LYS HD3 H 1 1.743 0.000 . . . . . A 100 LYS HD3 . 25855 1 658 . 1 1 100 100 LYS HE2 H 1 2.930 0.000 . . . . . A 100 LYS HE2 . 25855 1 659 . 1 1 100 100 LYS HE3 H 1 2.930 0.000 . . . . . A 100 LYS HE3 . 25855 1 660 . 1 1 100 100 LYS CA C 13 55.906 0.000 . . . . . A 100 LYS CA . 25855 1 661 . 1 1 100 100 LYS CB C 13 31.991 0.000 . . . . . A 100 LYS CB . 25855 1 662 . 1 1 100 100 LYS CG C 13 25.082 0.000 . . . . . A 100 LYS CG . 25855 1 663 . 1 1 101 101 GLU H H 1 7.569 0.002 . . . . . A 101 GLU H . 25855 1 664 . 1 1 101 101 GLU HA H 1 4.388 0.004 . . . . . A 101 GLU HA . 25855 1 665 . 1 1 101 101 GLU HB2 H 1 2.106 0.002 . . . . . A 101 GLU HB2 . 25855 1 666 . 1 1 101 101 GLU HB3 H 1 2.003 0.003 . . . . . A 101 GLU HB3 . 25855 1 667 . 1 1 101 101 GLU HG2 H 1 2.282 0.004 . . . . . A 101 GLU HG2 . 25855 1 668 . 1 1 101 101 GLU HG3 H 1 2.282 0.004 . . . . . A 101 GLU HG3 . 25855 1 669 . 1 1 101 101 GLU CA C 13 55.906 0.000 . . . . . A 101 GLU CA . 25855 1 670 . 1 1 101 101 GLU CB C 13 32.523 0.000 . . . . . A 101 GLU CB . 25855 1 671 . 1 1 101 101 GLU CG C 13 36.243 0.000 . . . . . A 101 GLU CG . 25855 1 672 . 1 1 102 102 GLU H H 1 8.440 0.003 . . . . . A 102 GLU H . 25855 1 673 . 1 1 102 102 GLU HA H 1 4.296 0.003 . . . . . A 102 GLU HA . 25855 1 674 . 1 1 102 102 GLU HB2 H 1 1.842 0.010 . . . . . A 102 GLU HB2 . 25855 1 675 . 1 1 102 102 GLU HB3 H 1 1.744 0.003 . . . . . A 102 GLU HB3 . 25855 1 676 . 1 1 102 102 GLU HG2 H 1 2.181 0.002 . . . . . A 102 GLU HG2 . 25855 1 677 . 1 1 102 102 GLU HG3 H 1 2.181 0.002 . . . . . A 102 GLU HG3 . 25855 1 678 . 1 1 102 102 GLU CA C 13 55.375 0.000 . . . . . A 102 GLU CA . 25855 1 679 . 1 1 102 102 GLU CB C 13 30.397 0.000 . . . . . A 102 GLU CB . 25855 1 680 . 1 1 102 102 GLU CG C 13 36.243 0.000 . . . . . A 102 GLU CG . 25855 1 681 . 1 1 103 103 VAL H H 1 8.552 0.005 . . . . . A 103 VAL H . 25855 1 682 . 1 1 103 103 VAL HA H 1 2.768 0.004 . . . . . A 103 VAL HA . 25855 1 683 . 1 1 103 103 VAL HB H 1 2.022 0.003 . . . . . A 103 VAL HB . 25855 1 684 . 1 1 103 103 VAL HG11 H 1 0.847 0.002 . . . . . A 103 VAL HG11 . 25855 1 685 . 1 1 103 103 VAL HG12 H 1 0.847 0.002 . . . . . A 103 VAL HG12 . 25855 1 686 . 1 1 103 103 VAL HG13 H 1 0.847 0.002 . . . . . A 103 VAL HG13 . 25855 1 687 . 1 1 103 103 VAL HG21 H 1 0.501 0.004 . . . . . A 103 VAL HG21 . 25855 1 688 . 1 1 103 103 VAL HG22 H 1 0.501 0.004 . . . . . A 103 VAL HG22 . 25855 1 689 . 1 1 103 103 VAL HG23 H 1 0.501 0.004 . . . . . A 103 VAL HG23 . 25855 1 690 . 1 1 103 103 VAL CA C 13 63.346 0.000 . . . . . A 103 VAL CA . 25855 1 691 . 1 1 103 103 VAL CB C 13 31.991 0.000 . . . . . A 103 VAL CB . 25855 1 692 . 1 1 103 103 VAL CG1 C 13 21.362 0.000 . . . . . A 103 VAL CG1 . 25855 1 693 . 1 1 103 103 VAL CG2 C 13 21.362 0.000 . . . . . A 103 VAL CG2 . 25855 1 694 . 1 1 104 104 LYS H H 1 6.924 0.005 . . . . . A 104 LYS H . 25855 1 695 . 1 1 104 104 LYS HA H 1 4.614 0.009 . . . . . A 104 LYS HA . 25855 1 696 . 1 1 104 104 LYS HB2 H 1 1.588 0.001 . . . . . A 104 LYS HB2 . 25855 1 697 . 1 1 104 104 LYS HB3 H 1 1.470 0.001 . . . . . A 104 LYS HB3 . 25855 1 698 . 1 1 104 104 LYS HG2 H 1 1.203 0.001 . . . . . A 104 LYS HG2 . 25855 1 699 . 1 1 104 104 LYS HG3 H 1 1.094 0.004 . . . . . A 104 LYS HG3 . 25855 1 700 . 1 1 104 104 LYS HD2 H 1 1.629 0.001 . . . . . A 104 LYS HD2 . 25855 1 701 . 1 1 104 104 LYS HD3 H 1 1.629 0.001 . . . . . A 104 LYS HD3 . 25855 1 702 . 1 1 104 104 LYS HE2 H 1 2.894 0.002 . . . . . A 104 LYS HE2 . 25855 1 703 . 1 1 104 104 LYS HE3 H 1 2.894 0.002 . . . . . A 104 LYS HE3 . 25855 1 704 . 1 1 104 104 LYS CA C 13 55.375 0.000 . . . . . A 104 LYS CA . 25855 1 705 . 1 1 104 104 LYS CB C 13 35.180 0.000 . . . . . A 104 LYS CB . 25855 1 706 . 1 1 104 104 LYS CG C 13 24.551 0.000 . . . . . A 104 LYS CG . 25855 1 707 . 1 1 104 104 LYS CD C 13 29.865 0.000 . . . . . A 104 LYS CD . 25855 1 708 . 1 1 104 104 LYS CE C 13 42.088 0.000 . . . . . A 104 LYS CE . 25855 1 709 . 1 1 105 105 LEU HA H 1 4.911 0.001 . . . . . A 105 LEU HA . 25855 1 710 . 1 1 105 105 LEU HB2 H 1 1.472 0.002 . . . . . A 105 LEU HB2 . 25855 1 711 . 1 1 105 105 LEU HB3 H 1 1.374 0.004 . . . . . A 105 LEU HB3 . 25855 1 712 . 1 1 105 105 LEU HG H 1 0.746 0.001 . . . . . A 105 LEU HG . 25855 1 713 . 1 1 105 105 LEU HD11 H 1 0.892 0.007 . . . . . A 105 LEU HD11 . 25855 1 714 . 1 1 105 105 LEU HD12 H 1 0.892 0.007 . . . . . A 105 LEU HD12 . 25855 1 715 . 1 1 105 105 LEU HD13 H 1 0.892 0.007 . . . . . A 105 LEU HD13 . 25855 1 716 . 1 1 105 105 LEU HD21 H 1 -0.206 0.002 . . . . . A 105 LEU HD21 . 25855 1 717 . 1 1 105 105 LEU HD22 H 1 -0.206 0.002 . . . . . A 105 LEU HD22 . 25855 1 718 . 1 1 105 105 LEU HD23 H 1 -0.206 0.002 . . . . . A 105 LEU HD23 . 25855 1 719 . 1 1 105 105 LEU CA C 13 52.717 0.000 . . . . . A 105 LEU CA . 25855 1 720 . 1 1 105 105 LEU CB C 13 45.277 0.000 . . . . . A 105 LEU CB . 25855 1 721 . 1 1 105 105 LEU CG C 13 27.740 0.000 . . . . . A 105 LEU CG . 25855 1 722 . 1 1 105 105 LEU CD1 C 13 22.425 0.000 . . . . . A 105 LEU CD1 . 25855 1 723 . 1 1 105 105 LEU CD2 C 13 24.019 0.000 . . . . . A 105 LEU CD2 . 25855 1 724 . 1 1 106 106 GLU H H 1 8.982 0.000 . . . . . A 106 GLU H . 25855 1 725 . 1 1 106 106 GLU HA H 1 4.908 0.003 . . . . . A 106 GLU HA . 25855 1 726 . 1 1 106 106 GLU HB2 H 1 2.045 0.002 . . . . . A 106 GLU HB2 . 25855 1 727 . 1 1 106 106 GLU HB3 H 1 1.957 0.001 . . . . . A 106 GLU HB3 . 25855 1 728 . 1 1 106 106 GLU CA C 13 57.055 0.000 . . . . . A 106 GLU CA . 25855 1 729 . 1 1 106 106 GLU CB C 13 32.070 0.000 . . . . . A 106 GLU CB . 25855 1 730 . 1 1 107 107 THR H H 1 9.357 0.000 . . . . . A 107 THR H . 25855 1 731 . 1 1 107 107 THR HA H 1 5.524 0.003 . . . . . A 107 THR HA . 25855 1 732 . 1 1 107 107 THR HB H 1 3.940 0.005 . . . . . A 107 THR HB . 25855 1 733 . 1 1 107 107 THR HG21 H 1 1.071 0.002 . . . . . A 107 THR HG21 . 25855 1 734 . 1 1 107 107 THR HG22 H 1 1.071 0.002 . . . . . A 107 THR HG22 . 25855 1 735 . 1 1 107 107 THR HG23 H 1 1.071 0.002 . . . . . A 107 THR HG23 . 25855 1 736 . 1 1 107 107 THR CA C 13 61.220 0.000 . . . . . A 107 THR CA . 25855 1 737 . 1 1 107 107 THR CB C 13 71.849 0.000 . . . . . A 107 THR CB . 25855 1 738 . 1 1 107 107 THR CG2 C 13 21.362 0.000 . . . . . A 107 THR CG2 . 25855 1 739 . 1 1 108 108 HIS HA H 1 6.061 0.003 . . . . . A 108 HIS HA . 25855 1 740 . 1 1 108 108 HIS HB2 H 1 3.245 0.005 . . . . . A 108 HIS HB2 . 25855 1 741 . 1 1 108 108 HIS HB3 H 1 3.023 0.001 . . . . . A 108 HIS HB3 . 25855 1 742 . 1 1 108 108 HIS CA C 13 53.249 0.000 . . . . . A 108 HIS CA . 25855 1 743 . 1 1 108 108 HIS CB C 13 35.180 0.000 . . . . . A 108 HIS CB . 25855 1 744 . 1 1 109 109 ILE H H 1 8.818 0.004 . . . . . A 109 ILE H . 25855 1 745 . 1 1 109 109 ILE HA H 1 4.640 0.004 . . . . . A 109 ILE HA . 25855 1 746 . 1 1 109 109 ILE HB H 1 1.831 0.003 . . . . . A 109 ILE HB . 25855 1 747 . 1 1 109 109 ILE HG12 H 1 1.324 0.003 . . . . . A 109 ILE HG12 . 25855 1 748 . 1 1 109 109 ILE HG13 H 1 1.010 0.002 . . . . . A 109 ILE HG13 . 25855 1 749 . 1 1 109 109 ILE HG21 H 1 0.855 0.006 . . . . . A 109 ILE HG21 . 25855 1 750 . 1 1 109 109 ILE HG22 H 1 0.855 0.006 . . . . . A 109 ILE HG22 . 25855 1 751 . 1 1 109 109 ILE HG23 H 1 0.855 0.006 . . . . . A 109 ILE HG23 . 25855 1 752 . 1 1 109 109 ILE HD11 H 1 0.717 0.006 . . . . . A 109 ILE HD11 . 25855 1 753 . 1 1 109 109 ILE HD12 H 1 0.717 0.006 . . . . . A 109 ILE HD12 . 25855 1 754 . 1 1 109 109 ILE HD13 H 1 0.717 0.006 . . . . . A 109 ILE HD13 . 25855 1 755 . 1 1 109 109 ILE CA C 13 59.095 0.000 . . . . . A 109 ILE CA . 25855 1 756 . 1 1 109 109 ILE CB C 13 41.026 0.000 . . . . . A 109 ILE CB . 25855 1 757 . 1 1 109 109 ILE CG1 C 13 27.208 0.000 . . . . . A 109 ILE CG1 . 25855 1 758 . 1 1 109 109 ILE CG2 C 13 18.174 0.000 . . . . . A 109 ILE CG2 . 25855 1 759 . 1 1 109 109 ILE CD1 C 13 13.922 0.000 . . . . . A 109 ILE CD1 . 25855 1 760 . 1 1 110 110 ARG H H 1 8.568 0.001 . . . . . A 110 ARG H . 25855 1 761 . 1 1 110 110 ARG HA H 1 5.234 0.005 . . . . . A 110 ARG HA . 25855 1 762 . 1 1 110 110 ARG HB2 H 1 1.647 0.003 . . . . . A 110 ARG HB2 . 25855 1 763 . 1 1 110 110 ARG HB3 H 1 1.517 0.002 . . . . . A 110 ARG HB3 . 25855 1 764 . 1 1 110 110 ARG HG2 H 1 1.586 0.007 . . . . . A 110 ARG HG2 . 25855 1 765 . 1 1 110 110 ARG HG3 H 1 1.341 0.004 . . . . . A 110 ARG HG3 . 25855 1 766 . 1 1 110 110 ARG HD2 H 1 2.979 0.000 . . . . . A 110 ARG HD2 . 25855 1 767 . 1 1 110 110 ARG HD3 H 1 2.917 0.002 . . . . . A 110 ARG HD3 . 25855 1 768 . 1 1 110 110 ARG CA C 13 54.843 0.000 . . . . . A 110 ARG CA . 25855 1 769 . 1 1 110 110 ARG CB C 13 31.991 0.000 . . . . . A 110 ARG CB . 25855 1 770 . 1 1 110 110 ARG CG C 13 27.740 0.000 . . . . . A 110 ARG CG . 25855 1 771 . 1 1 110 110 ARG CD C 13 43.151 0.000 . . . . . A 110 ARG CD . 25855 1 772 . 1 1 111 111 VAL H H 1 8.935 0.000 . . . . . A 111 VAL H . 25855 1 773 . 1 1 111 111 VAL HA H 1 4.874 0.004 . . . . . A 111 VAL HA . 25855 1 774 . 1 1 111 111 VAL HB H 1 1.959 0.001 . . . . . A 111 VAL HB . 25855 1 775 . 1 1 111 111 VAL HG11 H 1 0.736 0.016 . . . . . A 111 VAL HG11 . 25855 1 776 . 1 1 111 111 VAL HG12 H 1 0.736 0.016 . . . . . A 111 VAL HG12 . 25855 1 777 . 1 1 111 111 VAL HG13 H 1 0.736 0.016 . . . . . A 111 VAL HG13 . 25855 1 778 . 1 1 111 111 VAL HG21 H 1 0.527 0.006 . . . . . A 111 VAL HG21 . 25855 1 779 . 1 1 111 111 VAL HG22 H 1 0.527 0.006 . . . . . A 111 VAL HG22 . 25855 1 780 . 1 1 111 111 VAL HG23 H 1 0.527 0.006 . . . . . A 111 VAL HG23 . 25855 1 781 . 1 1 111 111 VAL CA C 13 56.969 0.000 . . . . . A 111 VAL CA . 25855 1 782 . 1 1 111 111 VAL CB C 13 33.585 0.000 . . . . . A 111 VAL CB . 25855 1 783 . 1 1 111 111 VAL CG1 C 13 21.894 0.000 . . . . . A 111 VAL CG1 . 25855 1 784 . 1 1 111 111 VAL CG2 C 13 18.705 0.000 . . . . . A 111 VAL CG2 . 25855 1 785 . 1 1 112 112 PRO HA H 1 4.499 0.007 . . . . . A 112 PRO HA . 25855 1 786 . 1 1 112 112 PRO HB2 H 1 2.487 0.001 . . . . . A 112 PRO HB2 . 25855 1 787 . 1 1 112 112 PRO HB3 H 1 1.824 0.004 . . . . . A 112 PRO HB3 . 25855 1 788 . 1 1 112 112 PRO HG2 H 1 2.050 0.002 . . . . . A 112 PRO HG2 . 25855 1 789 . 1 1 112 112 PRO HG3 H 1 2.050 0.002 . . . . . A 112 PRO HG3 . 25855 1 790 . 1 1 112 112 PRO HD2 H 1 3.914 0.005 . . . . . A 112 PRO HD2 . 25855 1 791 . 1 1 112 112 PRO HD3 H 1 3.358 0.001 . . . . . A 112 PRO HD3 . 25855 1 792 . 1 1 112 112 PRO CA C 13 63.346 0.000 . . . . . A 112 PRO CA . 25855 1 793 . 1 1 112 112 PRO CB C 13 31.991 0.000 . . . . . A 112 PRO CB . 25855 1 794 . 1 1 112 112 PRO CG C 13 28.271 0.000 . . . . . A 112 PRO CG . 25855 1 795 . 1 1 112 112 PRO CD C 13 50.592 0.000 . . . . . A 112 PRO CD . 25855 1 796 . 1 1 113 113 ALA H H 1 9.220 0.049 . . . . . A 113 ALA H . 25855 1 797 . 1 1 113 113 ALA HA H 1 3.910 0.004 . . . . . A 113 ALA HA . 25855 1 798 . 1 1 113 113 ALA HB1 H 1 1.351 0.002 . . . . . A 113 ALA HB1 . 25855 1 799 . 1 1 113 113 ALA HB2 H 1 1.351 0.002 . . . . . A 113 ALA HB2 . 25855 1 800 . 1 1 113 113 ALA HB3 H 1 1.351 0.002 . . . . . A 113 ALA HB3 . 25855 1 801 . 1 1 113 113 ALA CA C 13 55.906 0.000 . . . . . A 113 ALA CA . 25855 1 802 . 1 1 113 113 ALA CB C 13 18.174 0.000 . . . . . A 113 ALA CB . 25855 1 803 . 1 1 114 114 SER HA H 1 4.210 0.006 . . . . . A 114 SER HA . 25855 1 804 . 1 1 114 114 SER HB2 H 1 3.965 0.000 . . . . . A 114 SER HB2 . 25855 1 805 . 1 1 114 114 SER HB3 H 1 3.965 0.000 . . . . . A 114 SER HB3 . 25855 1 806 . 1 1 114 114 SER CA C 13 60.157 0.000 . . . . . A 114 SER CA . 25855 1 807 . 1 1 115 115 ALA H H 1 7.752 0.000 . . . . . A 115 ALA H . 25855 1 808 . 1 1 115 115 ALA HA H 1 4.485 0.003 . . . . . A 115 ALA HA . 25855 1 809 . 1 1 115 115 ALA HB1 H 1 1.340 0.003 . . . . . A 115 ALA HB1 . 25855 1 810 . 1 1 115 115 ALA HB2 H 1 1.340 0.003 . . . . . A 115 ALA HB2 . 25855 1 811 . 1 1 115 115 ALA HB3 H 1 1.340 0.003 . . . . . A 115 ALA HB3 . 25855 1 812 . 1 1 115 115 ALA CA C 13 52.186 0.000 . . . . . A 115 ALA CA . 25855 1 813 . 1 1 115 115 ALA CB C 13 20.299 0.000 . . . . . A 115 ALA CB . 25855 1 814 . 1 1 116 116 ALA H H 1 7.429 0.005 . . . . . A 116 ALA H . 25855 1 815 . 1 1 116 116 ALA HA H 1 3.587 0.011 . . . . . A 116 ALA HA . 25855 1 816 . 1 1 116 116 ALA HB1 H 1 1.210 0.006 . . . . . A 116 ALA HB1 . 25855 1 817 . 1 1 116 116 ALA HB2 H 1 1.210 0.006 . . . . . A 116 ALA HB2 . 25855 1 818 . 1 1 116 116 ALA HB3 H 1 1.210 0.006 . . . . . A 116 ALA HB3 . 25855 1 819 . 1 1 116 116 ALA CA C 13 55.375 0.000 . . . . . A 116 ALA CA . 25855 1 820 . 1 1 116 116 ALA CB C 13 18.174 0.000 . . . . . A 116 ALA CB . 25855 1 821 . 1 1 117 117 GLY HA2 H 1 3.854 0.008 . . . . . A 117 GLY HA2 . 25855 1 822 . 1 1 117 117 GLY HA3 H 1 3.854 0.008 . . . . . A 117 GLY HA3 . 25855 1 823 . 1 1 117 117 GLY CA C 13 46.340 0.000 . . . . . A 117 GLY CA . 25855 1 824 . 1 1 118 118 ARG HA H 1 4.177 0.008 . . . . . A 118 ARG HA . 25855 1 825 . 1 1 118 118 ARG HB2 H 1 1.844 0.003 . . . . . A 118 ARG HB2 . 25855 1 826 . 1 1 118 118 ARG HB3 H 1 1.844 0.003 . . . . . A 118 ARG HB3 . 25855 1 827 . 1 1 118 118 ARG HG2 H 1 1.685 0.012 . . . . . A 118 ARG HG2 . 25855 1 828 . 1 1 118 118 ARG HG3 H 1 1.685 0.012 . . . . . A 118 ARG HG3 . 25855 1 829 . 1 1 118 118 ARG HD2 H 1 3.153 0.006 . . . . . A 118 ARG HD2 . 25855 1 830 . 1 1 118 118 ARG HD3 H 1 3.153 0.006 . . . . . A 118 ARG HD3 . 25855 1 831 . 1 1 118 118 ARG CB C 13 30.397 0.000 . . . . . A 118 ARG CB . 25855 1 832 . 1 1 118 118 ARG CG C 13 27.208 0.000 . . . . . A 118 ARG CG . 25855 1 833 . 1 1 118 118 ARG CD C 13 43.151 0.000 . . . . . A 118 ARG CD . 25855 1 834 . 1 1 119 119 VAL HA H 1 3.652 0.014 . . . . . A 119 VAL HA . 25855 1 835 . 1 1 119 119 VAL HB H 1 2.155 0.015 . . . . . A 119 VAL HB . 25855 1 836 . 1 1 119 119 VAL HG11 H 1 0.814 0.002 . . . . . A 119 VAL HG11 . 25855 1 837 . 1 1 119 119 VAL HG12 H 1 0.814 0.002 . . . . . A 119 VAL HG12 . 25855 1 838 . 1 1 119 119 VAL HG13 H 1 0.814 0.002 . . . . . A 119 VAL HG13 . 25855 1 839 . 1 1 119 119 VAL HG21 H 1 0.711 0.016 . . . . . A 119 VAL HG21 . 25855 1 840 . 1 1 119 119 VAL HG22 H 1 0.711 0.016 . . . . . A 119 VAL HG22 . 25855 1 841 . 1 1 119 119 VAL HG23 H 1 0.711 0.016 . . . . . A 119 VAL HG23 . 25855 1 842 . 1 1 119 119 VAL CA C 13 64.940 0.000 . . . . . A 119 VAL CA . 25855 1 843 . 1 1 119 119 VAL CB C 13 31.991 0.000 . . . . . A 119 VAL CB . 25855 1 844 . 1 1 119 119 VAL CG1 C 13 21.894 0.000 . . . . . A 119 VAL CG1 . 25855 1 845 . 1 1 119 119 VAL CG2 C 13 8.160 8.171 . . . . . A 119 VAL CG2 . 25855 1 846 . 1 1 120 120 ILE HA H 1 3.827 0.000 . . . . . A 120 ILE HA . 25855 1 847 . 1 1 120 120 ILE HB H 1 1.711 0.007 . . . . . A 120 ILE HB . 25855 1 848 . 1 1 120 120 ILE HG12 H 1 1.535 0.000 . . . . . A 120 ILE HG12 . 25855 1 849 . 1 1 120 120 ILE HG13 H 1 1.535 0.000 . . . . . A 120 ILE HG13 . 25855 1 850 . 1 1 120 120 ILE HG21 H 1 0.980 0.004 . . . . . A 120 ILE HG21 . 25855 1 851 . 1 1 120 120 ILE HG22 H 1 0.980 0.004 . . . . . A 120 ILE HG22 . 25855 1 852 . 1 1 120 120 ILE HG23 H 1 0.980 0.004 . . . . . A 120 ILE HG23 . 25855 1 853 . 1 1 120 120 ILE HD11 H 1 0.736 0.025 . . . . . A 120 ILE HD11 . 25855 1 854 . 1 1 120 120 ILE HD12 H 1 0.736 0.025 . . . . . A 120 ILE HD12 . 25855 1 855 . 1 1 120 120 ILE HD13 H 1 0.736 0.025 . . . . . A 120 ILE HD13 . 25855 1 856 . 1 1 120 120 ILE CB C 13 39.431 0.000 . . . . . A 120 ILE CB . 25855 1 857 . 1 1 120 120 ILE CG2 C 13 18.174 0.000 . . . . . A 120 ILE CG2 . 25855 1 858 . 1 1 121 121 GLY H H 1 7.924 0.004 . . . . . A 121 GLY H . 25855 1 859 . 1 1 121 121 GLY HA2 H 1 4.097 0.002 . . . . . A 121 GLY HA2 . 25855 1 860 . 1 1 121 121 GLY HA3 H 1 3.917 0.001 . . . . . A 121 GLY HA3 . 25855 1 861 . 1 1 121 121 GLY CA C 13 43.062 0.000 . . . . . A 121 GLY CA . 25855 1 862 . 1 1 125 125 LYS HA H 1 4.147 0.000 . . . . . A 125 LYS HA . 25855 1 863 . 1 1 127 127 VAL HA H 1 3.919 0.005 . . . . . A 127 VAL HA . 25855 1 864 . 1 1 127 127 VAL HG21 H 1 0.701 0.093 . . . . . A 127 VAL HG21 . 25855 1 865 . 1 1 127 127 VAL HG22 H 1 0.701 0.093 . . . . . A 127 VAL HG22 . 25855 1 866 . 1 1 127 127 VAL HG23 H 1 0.701 0.093 . . . . . A 127 VAL HG23 . 25855 1 867 . 1 1 128 128 ASN H H 1 8.050 0.000 . . . . . A 128 ASN H . 25855 1 868 . 1 1 128 128 ASN HA H 1 4.488 0.013 . . . . . A 128 ASN HA . 25855 1 869 . 1 1 128 128 ASN HB2 H 1 2.853 0.003 . . . . . A 128 ASN HB2 . 25855 1 870 . 1 1 128 128 ASN HB3 H 1 2.853 0.003 . . . . . A 128 ASN HB3 . 25855 1 871 . 1 1 128 128 ASN HD21 H 1 7.534 0.000 . . . . . A 128 ASN HD21 . 25855 1 872 . 1 1 128 128 ASN HD22 H 1 6.808 0.000 . . . . . A 128 ASN HD22 . 25855 1 873 . 1 1 128 128 ASN CA C 13 55.375 0.000 . . . . . A 128 ASN CA . 25855 1 874 . 1 1 128 128 ASN CB C 13 38.368 0.000 . . . . . A 128 ASN CB . 25855 1 875 . 1 1 129 129 GLU H H 1 8.138 0.000 . . . . . A 129 GLU H . 25855 1 876 . 1 1 130 130 LEU HA H 1 4.060 0.000 . . . . . A 130 LEU HA . 25855 1 877 . 1 1 130 130 LEU HB2 H 1 1.920 0.002 . . . . . A 130 LEU HB2 . 25855 1 878 . 1 1 130 130 LEU HB3 H 1 1.412 0.007 . . . . . A 130 LEU HB3 . 25855 1 879 . 1 1 130 130 LEU HG H 1 1.728 0.000 . . . . . A 130 LEU HG . 25855 1 880 . 1 1 130 130 LEU HD11 H 1 0.801 0.005 . . . . . A 130 LEU HD11 . 25855 1 881 . 1 1 130 130 LEU HD12 H 1 0.801 0.005 . . . . . A 130 LEU HD12 . 25855 1 882 . 1 1 130 130 LEU HD13 H 1 0.801 0.005 . . . . . A 130 LEU HD13 . 25855 1 883 . 1 1 130 130 LEU HD21 H 1 0.763 0.005 . . . . . A 130 LEU HD21 . 25855 1 884 . 1 1 130 130 LEU HD22 H 1 0.763 0.005 . . . . . A 130 LEU HD22 . 25855 1 885 . 1 1 130 130 LEU HD23 H 1 0.763 0.005 . . . . . A 130 LEU HD23 . 25855 1 886 . 1 1 130 130 LEU CB C 13 42.088 0.000 . . . . . A 130 LEU CB . 25855 1 887 . 1 1 130 130 LEU CD1 C 13 25.614 0.000 . . . . . A 130 LEU CD1 . 25855 1 888 . 1 1 130 130 LEU CD2 C 13 25.614 0.000 . . . . . A 130 LEU CD2 . 25855 1 889 . 1 1 131 131 GLN HA H 1 4.294 0.006 . . . . . A 131 GLN HA . 25855 1 890 . 1 1 131 131 GLN HB2 H 1 2.188 0.003 . . . . . A 131 GLN HB2 . 25855 1 891 . 1 1 131 131 GLN HB3 H 1 2.188 0.003 . . . . . A 131 GLN HB3 . 25855 1 892 . 1 1 131 131 GLN HG2 H 1 2.652 0.002 . . . . . A 131 GLN HG2 . 25855 1 893 . 1 1 131 131 GLN HG3 H 1 2.457 0.007 . . . . . A 131 GLN HG3 . 25855 1 894 . 1 1 131 131 GLN HE22 H 1 6.816 0.000 . . . . . A 131 GLN HE22 . 25855 1 895 . 1 1 131 131 GLN CA C 13 59.095 0.000 . . . . . A 131 GLN CA . 25855 1 896 . 1 1 131 131 GLN CB C 13 29.281 0.106 . . . . . A 131 GLN CB . 25855 1 897 . 1 1 131 131 GLN CG C 13 34.648 0.000 . . . . . A 131 GLN CG . 25855 1 898 . 1 1 133 133 LEU HA H 1 4.271 0.000 . . . . . A 133 LEU HA . 25855 1 899 . 1 1 133 133 LEU HB2 H 1 1.764 0.014 . . . . . A 133 LEU HB2 . 25855 1 900 . 1 1 133 133 LEU HB3 H 1 1.588 0.002 . . . . . A 133 LEU HB3 . 25855 1 901 . 1 1 133 133 LEU HG H 1 1.085 0.000 . . . . . A 133 LEU HG . 25855 1 902 . 1 1 133 133 LEU HD11 H 1 0.864 0.001 . . . . . A 133 LEU HD11 . 25855 1 903 . 1 1 133 133 LEU HD12 H 1 0.864 0.001 . . . . . A 133 LEU HD12 . 25855 1 904 . 1 1 133 133 LEU HD13 H 1 0.864 0.001 . . . . . A 133 LEU HD13 . 25855 1 905 . 1 1 133 133 LEU HD21 H 1 0.831 0.002 . . . . . A 133 LEU HD21 . 25855 1 906 . 1 1 133 133 LEU HD22 H 1 0.831 0.002 . . . . . A 133 LEU HD22 . 25855 1 907 . 1 1 133 133 LEU HD23 H 1 0.831 0.002 . . . . . A 133 LEU HD23 . 25855 1 908 . 1 1 133 133 LEU CB C 13 43.151 0.000 . . . . . A 133 LEU CB . 25855 1 909 . 1 1 133 133 LEU CD1 C 13 25.075 0.005 . . . . . A 133 LEU CD1 . 25855 1 910 . 1 1 133 133 LEU CD2 C 13 23.488 0.000 . . . . . A 133 LEU CD2 . 25855 1 911 . 1 1 134 134 THR HA H 1 4.324 0.005 . . . . . A 134 THR HA . 25855 1 912 . 1 1 134 134 THR HB H 1 4.106 0.002 . . . . . A 134 THR HB . 25855 1 913 . 1 1 134 134 THR HG21 H 1 1.096 0.002 . . . . . A 134 THR HG21 . 25855 1 914 . 1 1 134 134 THR HG22 H 1 1.096 0.002 . . . . . A 134 THR HG22 . 25855 1 915 . 1 1 134 134 THR HG23 H 1 1.096 0.002 . . . . . A 134 THR HG23 . 25855 1 916 . 1 1 134 134 THR CA C 13 61.752 0.000 . . . . . A 134 THR CA . 25855 1 917 . 1 1 134 134 THR CB C 13 70.047 0.000 . . . . . A 134 THR CB . 25855 1 918 . 1 1 135 135 ALA H H 1 8.013 0.003 . . . . . A 135 ALA H . 25855 1 919 . 1 1 135 135 ALA HA H 1 4.107 0.002 . . . . . A 135 ALA HA . 25855 1 920 . 1 1 135 135 ALA HB1 H 1 1.559 0.017 . . . . . A 135 ALA HB1 . 25855 1 921 . 1 1 135 135 ALA HB2 H 1 1.559 0.017 . . . . . A 135 ALA HB2 . 25855 1 922 . 1 1 135 135 ALA HB3 H 1 1.559 0.017 . . . . . A 135 ALA HB3 . 25855 1 923 . 1 1 135 135 ALA CA C 13 53.780 0.000 . . . . . A 135 ALA CA . 25855 1 924 . 1 1 135 135 ALA CB C 13 18.174 0.000 . . . . . A 135 ALA CB . 25855 1 925 . 1 1 136 136 ALA H H 1 8.011 0.000 . . . . . A 136 ALA H . 25855 1 926 . 1 1 136 136 ALA HA H 1 4.539 0.003 . . . . . A 136 ALA HA . 25855 1 927 . 1 1 136 136 ALA HB1 H 1 0.932 0.004 . . . . . A 136 ALA HB1 . 25855 1 928 . 1 1 136 136 ALA HB2 H 1 0.932 0.004 . . . . . A 136 ALA HB2 . 25855 1 929 . 1 1 136 136 ALA HB3 H 1 0.932 0.004 . . . . . A 136 ALA HB3 . 25855 1 930 . 1 1 136 136 ALA CA C 13 51.123 0.000 . . . . . A 136 ALA CA . 25855 1 931 . 1 1 136 136 ALA CB C 13 19.768 0.000 . . . . . A 136 ALA CB . 25855 1 932 . 1 1 137 137 GLU H H 1 8.439 0.002 . . . . . A 137 GLU H . 25855 1 933 . 1 1 137 137 GLU HA H 1 4.431 0.004 . . . . . A 137 GLU HA . 25855 1 934 . 1 1 137 137 GLU HB2 H 1 2.194 0.001 . . . . . A 137 GLU HB2 . 25855 1 935 . 1 1 137 137 GLU HB3 H 1 2.020 0.002 . . . . . A 137 GLU HB3 . 25855 1 936 . 1 1 137 137 GLU CB C 13 36.243 0.000 . . . . . A 137 GLU CB . 25855 1 937 . 1 1 138 138 VAL H H 1 8.280 0.003 . . . . . A 138 VAL H . 25855 1 938 . 1 1 138 138 VAL HA H 1 4.882 0.004 . . . . . A 138 VAL HA . 25855 1 939 . 1 1 138 138 VAL HB H 1 1.769 0.002 . . . . . A 138 VAL HB . 25855 1 940 . 1 1 138 138 VAL HG11 H 1 0.685 0.009 . . . . . A 138 VAL HG11 . 25855 1 941 . 1 1 138 138 VAL HG12 H 1 0.685 0.009 . . . . . A 138 VAL HG12 . 25855 1 942 . 1 1 138 138 VAL HG13 H 1 0.685 0.009 . . . . . A 138 VAL HG13 . 25855 1 943 . 1 1 138 138 VAL HG21 H 1 0.595 0.004 . . . . . A 138 VAL HG21 . 25855 1 944 . 1 1 138 138 VAL HG22 H 1 0.595 0.004 . . . . . A 138 VAL HG22 . 25855 1 945 . 1 1 138 138 VAL HG23 H 1 0.595 0.004 . . . . . A 138 VAL HG23 . 25855 1 946 . 1 1 138 138 VAL CA C 13 61.220 0.000 . . . . . A 138 VAL CA . 25855 1 947 . 1 1 138 138 VAL CB C 13 33.585 0.000 . . . . . A 138 VAL CB . 25855 1 948 . 1 1 138 138 VAL CG1 C 13 20.831 0.000 . . . . . A 138 VAL CG1 . 25855 1 949 . 1 1 138 138 VAL CG2 C 13 21.362 0.000 . . . . . A 138 VAL CG2 . 25855 1 950 . 1 1 139 139 VAL H H 1 9.055 0.003 . . . . . A 139 VAL H . 25855 1 951 . 1 1 139 139 VAL HA H 1 4.221 0.003 . . . . . A 139 VAL HA . 25855 1 952 . 1 1 139 139 VAL HB H 1 1.773 0.007 . . . . . A 139 VAL HB . 25855 1 953 . 1 1 139 139 VAL HG11 H 1 0.790 0.003 . . . . . A 139 VAL HG11 . 25855 1 954 . 1 1 139 139 VAL HG12 H 1 0.790 0.003 . . . . . A 139 VAL HG12 . 25855 1 955 . 1 1 139 139 VAL HG13 H 1 0.790 0.003 . . . . . A 139 VAL HG13 . 25855 1 956 . 1 1 139 139 VAL HG21 H 1 0.790 0.003 . . . . . A 139 VAL HG21 . 25855 1 957 . 1 1 139 139 VAL HG22 H 1 0.790 0.003 . . . . . A 139 VAL HG22 . 25855 1 958 . 1 1 139 139 VAL HG23 H 1 0.790 0.003 . . . . . A 139 VAL HG23 . 25855 1 959 . 1 1 139 139 VAL CA C 13 60.689 0.000 . . . . . A 139 VAL CA . 25855 1 960 . 1 1 139 139 VAL CB C 13 36.243 0.000 . . . . . A 139 VAL CB . 25855 1 961 . 1 1 139 139 VAL CG1 C 13 20.831 0.000 . . . . . A 139 VAL CG1 . 25855 1 962 . 1 1 140 140 VAL HA H 1 4.622 0.006 . . . . . A 140 VAL HA . 25855 1 963 . 1 1 140 140 VAL HB H 1 2.041 0.004 . . . . . A 140 VAL HB . 25855 1 964 . 1 1 140 140 VAL HG11 H 1 0.764 0.002 . . . . . A 140 VAL HG11 . 25855 1 965 . 1 1 140 140 VAL HG12 H 1 0.764 0.002 . . . . . A 140 VAL HG12 . 25855 1 966 . 1 1 140 140 VAL HG13 H 1 0.764 0.002 . . . . . A 140 VAL HG13 . 25855 1 967 . 1 1 140 140 VAL HG21 H 1 0.727 0.000 . . . . . A 140 VAL HG21 . 25855 1 968 . 1 1 140 140 VAL HG22 H 1 0.727 0.000 . . . . . A 140 VAL HG22 . 25855 1 969 . 1 1 140 140 VAL HG23 H 1 0.727 0.000 . . . . . A 140 VAL HG23 . 25855 1 970 . 1 1 140 140 VAL CA C 13 58.563 0.000 . . . . . A 140 VAL CA . 25855 1 971 . 1 1 140 140 VAL CB C 13 31.991 0.000 . . . . . A 140 VAL CB . 25855 1 972 . 1 1 140 140 VAL CG1 C 13 20.299 0.000 . . . . . A 140 VAL CG1 . 25855 1 973 . 1 1 141 141 PRO HA H 1 4.229 0.002 . . . . . A 141 PRO HA . 25855 1 974 . 1 1 141 141 PRO HB2 H 1 2.317 0.006 . . . . . A 141 PRO HB2 . 25855 1 975 . 1 1 141 141 PRO HB3 H 1 1.702 0.005 . . . . . A 141 PRO HB3 . 25855 1 976 . 1 1 141 141 PRO HG2 H 1 1.914 0.001 . . . . . A 141 PRO HG2 . 25855 1 977 . 1 1 141 141 PRO HG3 H 1 1.914 0.001 . . . . . A 141 PRO HG3 . 25855 1 978 . 1 1 141 141 PRO HD2 H 1 3.683 0.003 . . . . . A 141 PRO HD2 . 25855 1 979 . 1 1 141 141 PRO HD3 H 1 3.683 0.003 . . . . . A 141 PRO HD3 . 25855 1 980 . 1 1 141 141 PRO CA C 13 63.346 0.000 . . . . . A 141 PRO CA . 25855 1 981 . 1 1 141 141 PRO CB C 13 31.460 0.000 . . . . . A 141 PRO CB . 25855 1 982 . 1 1 141 141 PRO CG C 13 27.071 0.000 . . . . . A 141 PRO CG . 25855 1 983 . 1 1 141 141 PRO CD C 13 50.592 0.000 . . . . . A 141 PRO CD . 25855 1 984 . 1 1 142 142 ARG H H 1 8.499 0.000 . . . . . A 142 ARG H . 25855 1 985 . 1 1 142 142 ARG HA H 1 4.234 0.002 . . . . . A 142 ARG HA . 25855 1 986 . 1 1 142 142 ARG HB2 H 1 1.737 0.010 . . . . . A 142 ARG HB2 . 25855 1 987 . 1 1 142 142 ARG HB3 H 1 1.737 0.010 . . . . . A 142 ARG HB3 . 25855 1 988 . 1 1 142 142 ARG HG2 H 1 1.847 0.000 . . . . . A 142 ARG HG2 . 25855 1 989 . 1 1 142 142 ARG HG3 H 1 1.847 0.000 . . . . . A 142 ARG HG3 . 25855 1 990 . 1 1 142 142 ARG HD2 H 1 3.165 0.004 . . . . . A 142 ARG HD2 . 25855 1 991 . 1 1 142 142 ARG HD3 H 1 3.165 0.004 . . . . . A 142 ARG HD3 . 25855 1 992 . 1 1 142 142 ARG CA C 13 56.437 0.000 . . . . . A 142 ARG CA . 25855 1 993 . 1 1 142 142 ARG CB C 13 30.928 0.000 . . . . . A 142 ARG CB . 25855 1 994 . 1 1 142 142 ARG CD C 13 43.151 0.000 . . . . . A 142 ARG CD . 25855 1 995 . 1 1 143 143 ASP H H 1 8.691 0.000 . . . . . A 143 ASP H . 25855 1 996 . 1 1 143 143 ASP HA H 1 4.410 0.003 . . . . . A 143 ASP HA . 25855 1 997 . 1 1 143 143 ASP HB2 H 1 2.702 0.003 . . . . . A 143 ASP HB2 . 25855 1 998 . 1 1 143 143 ASP HB3 H 1 2.618 0.003 . . . . . A 143 ASP HB3 . 25855 1 999 . 1 1 143 143 ASP CA C 13 54.312 0.000 . . . . . A 143 ASP CA . 25855 1 1000 . 1 1 143 143 ASP CB C 13 39.431 0.000 . . . . . A 143 ASP CB . 25855 1 1001 . 1 1 144 144 GLN H H 1 7.898 0.001 . . . . . A 144 GLN H . 25855 1 1002 . 1 1 144 144 GLN HA H 1 4.365 0.004 . . . . . A 144 GLN HA . 25855 1 1003 . 1 1 144 144 GLN HB2 H 1 1.893 0.040 . . . . . A 144 GLN HB2 . 25855 1 1004 . 1 1 144 144 GLN HB3 H 1 1.893 0.040 . . . . . A 144 GLN HB3 . 25855 1 1005 . 1 1 144 144 GLN HG2 H 1 2.104 0.003 . . . . . A 144 GLN HG2 . 25855 1 1006 . 1 1 144 144 GLN HG3 H 1 2.104 0.003 . . . . . A 144 GLN HG3 . 25855 1 1007 . 1 1 144 144 GLN CA C 13 55.056 0.000 . . . . . A 144 GLN CA . 25855 1 1008 . 1 1 144 144 GLN CB C 13 31.069 0.000 . . . . . A 144 GLN CB . 25855 1 1009 . 1 1 144 144 GLN CG C 13 34.067 0.000 . . . . . A 144 GLN CG . 25855 1 1010 . 1 1 145 145 THR H H 1 8.695 0.003 . . . . . A 145 THR H . 25855 1 1011 . 1 1 145 145 THR HA H 1 4.619 0.004 . . . . . A 145 THR HA . 25855 1 1012 . 1 1 145 145 THR HB H 1 4.026 0.004 . . . . . A 145 THR HB . 25855 1 1013 . 1 1 145 145 THR HG21 H 1 1.238 0.003 . . . . . A 145 THR HG21 . 25855 1 1014 . 1 1 145 145 THR HG22 H 1 1.238 0.003 . . . . . A 145 THR HG22 . 25855 1 1015 . 1 1 145 145 THR HG23 H 1 1.238 0.003 . . . . . A 145 THR HG23 . 25855 1 1016 . 1 1 145 145 THR CA C 13 59.626 0.000 . . . . . A 145 THR CA . 25855 1 1017 . 1 1 145 145 THR CB C 13 70.255 0.000 . . . . . A 145 THR CB . 25855 1 1018 . 1 1 145 145 THR CG2 C 13 21.362 0.000 . . . . . A 145 THR CG2 . 25855 1 1019 . 1 1 146 146 PRO HA H 1 4.340 0.002 . . . . . A 146 PRO HA . 25855 1 1020 . 1 1 146 146 PRO HG2 H 1 1.636 0.003 . . . . . A 146 PRO HG2 . 25855 1 1021 . 1 1 146 146 PRO HG3 H 1 1.636 0.003 . . . . . A 146 PRO HG3 . 25855 1 1022 . 1 1 146 146 PRO HD2 H 1 3.957 0.004 . . . . . A 146 PRO HD2 . 25855 1 1023 . 1 1 146 146 PRO HD3 H 1 3.613 0.002 . . . . . A 146 PRO HD3 . 25855 1 1024 . 1 1 146 146 PRO CA C 13 62.815 0.000 . . . . . A 146 PRO CA . 25855 1 1025 . 1 1 146 146 PRO CG C 13 27.740 0.000 . . . . . A 146 PRO CG . 25855 1 1026 . 1 1 146 146 PRO CD C 13 51.123 0.000 . . . . . A 146 PRO CD . 25855 1 1027 . 1 1 147 147 ASP H H 1 8.506 0.000 . . . . . A 147 ASP H . 25855 1 1028 . 1 1 147 147 ASP HA H 1 4.549 0.004 . . . . . A 147 ASP HA . 25855 1 1029 . 1 1 147 147 ASP HB2 H 1 3.248 0.002 . . . . . A 147 ASP HB2 . 25855 1 1030 . 1 1 147 147 ASP HB3 H 1 2.768 0.003 . . . . . A 147 ASP HB3 . 25855 1 1031 . 1 1 147 147 ASP CA C 13 52.717 0.000 . . . . . A 147 ASP CA . 25855 1 1032 . 1 1 147 147 ASP CB C 13 41.026 0.000 . . . . . A 147 ASP CB . 25855 1 1033 . 1 1 148 148 GLU H H 1 9.159 0.001 . . . . . A 148 GLU H . 25855 1 1034 . 1 1 148 148 GLU HA H 1 4.170 0.004 . . . . . A 148 GLU HA . 25855 1 1035 . 1 1 148 148 GLU HB2 H 1 2.025 0.001 . . . . . A 148 GLU HB2 . 25855 1 1036 . 1 1 148 148 GLU HB3 H 1 2.025 0.001 . . . . . A 148 GLU HB3 . 25855 1 1037 . 1 1 148 148 GLU HG2 H 1 2.261 0.001 . . . . . A 148 GLU HG2 . 25855 1 1038 . 1 1 148 148 GLU HG3 H 1 2.210 0.002 . . . . . A 148 GLU HG3 . 25855 1 1039 . 1 1 148 148 GLU CA C 13 58.563 0.000 . . . . . A 148 GLU CA . 25855 1 1040 . 1 1 148 148 GLU CB C 13 28.271 0.000 . . . . . A 148 GLU CB . 25855 1 1041 . 1 1 148 148 GLU CG C 13 35.711 0.000 . . . . . A 148 GLU CG . 25855 1 1042 . 1 1 149 149 ASN H H 1 8.364 0.002 . . . . . A 149 ASN H . 25855 1 1043 . 1 1 149 149 ASN HA H 1 4.936 0.001 . . . . . A 149 ASN HA . 25855 1 1044 . 1 1 149 149 ASN HB2 H 1 2.910 0.002 . . . . . A 149 ASN HB2 . 25855 1 1045 . 1 1 149 149 ASN HB3 H 1 2.606 0.003 . . . . . A 149 ASN HB3 . 25855 1 1046 . 1 1 149 149 ASN HD21 H 1 7.807 0.002 . . . . . A 149 ASN HD21 . 25855 1 1047 . 1 1 149 149 ASN HD22 H 1 6.849 0.002 . . . . . A 149 ASN HD22 . 25855 1 1048 . 1 1 149 149 ASN CA C 13 52.717 0.000 . . . . . A 149 ASN CA . 25855 1 1049 . 1 1 149 149 ASN CB C 13 39.431 0.000 . . . . . A 149 ASN CB . 25855 1 1050 . 1 1 150 150 GLU H H 1 8.542 0.008 . . . . . A 150 GLU H . 25855 1 1051 . 1 1 150 150 GLU HA H 1 3.771 0.005 . . . . . A 150 GLU HA . 25855 1 1052 . 1 1 150 150 GLU HB2 H 1 2.375 0.003 . . . . . A 150 GLU HB2 . 25855 1 1053 . 1 1 150 150 GLU HB3 H 1 2.209 0.007 . . . . . A 150 GLU HB3 . 25855 1 1054 . 1 1 150 150 GLU HG2 H 1 2.213 0.003 . . . . . A 150 GLU HG2 . 25855 1 1055 . 1 1 150 150 GLU HG3 H 1 2.213 0.003 . . . . . A 150 GLU HG3 . 25855 1 1056 . 1 1 150 150 GLU CA C 13 57.500 0.000 . . . . . A 150 GLU CA . 25855 1 1057 . 1 1 150 150 GLU CB C 13 27.850 0.156 . . . . . A 150 GLU CB . 25855 1 1058 . 1 1 150 150 GLU CG C 13 37.306 0.000 . . . . . A 150 GLU CG . 25855 1 1059 . 1 1 151 151 GLN H H 1 8.441 0.003 . . . . . A 151 GLN H . 25855 1 1060 . 1 1 151 151 GLN HA H 1 5.021 0.005 . . . . . A 151 GLN HA . 25855 1 1061 . 1 1 151 151 GLN HB2 H 1 2.227 0.000 . . . . . A 151 GLN HB2 . 25855 1 1062 . 1 1 151 151 GLN HB3 H 1 1.803 0.000 . . . . . A 151 GLN HB3 . 25855 1 1063 . 1 1 151 151 GLN HG2 H 1 2.283 0.001 . . . . . A 151 GLN HG2 . 25855 1 1064 . 1 1 151 151 GLN HG3 H 1 1.801 0.002 . . . . . A 151 GLN HG3 . 25855 1 1065 . 1 1 151 151 GLN CA C 13 54.843 0.000 . . . . . A 151 GLN CA . 25855 1 1066 . 1 1 151 151 GLN CB C 13 31.069 0.000 . . . . . A 151 GLN CB . 25855 1 1067 . 1 1 151 151 GLN CG C 13 34.648 0.000 . . . . . A 151 GLN CG . 25855 1 1068 . 1 1 152 152 VAL H H 1 8.999 0.002 . . . . . A 152 VAL H . 25855 1 1069 . 1 1 152 152 VAL HA H 1 4.582 0.007 . . . . . A 152 VAL HA . 25855 1 1070 . 1 1 152 152 VAL HB H 1 1.971 0.003 . . . . . A 152 VAL HB . 25855 1 1071 . 1 1 152 152 VAL HG11 H 1 0.643 0.003 . . . . . A 152 VAL HG11 . 25855 1 1072 . 1 1 152 152 VAL HG12 H 1 0.643 0.003 . . . . . A 152 VAL HG12 . 25855 1 1073 . 1 1 152 152 VAL HG13 H 1 0.643 0.003 . . . . . A 152 VAL HG13 . 25855 1 1074 . 1 1 152 152 VAL HG21 H 1 0.544 0.003 . . . . . A 152 VAL HG21 . 25855 1 1075 . 1 1 152 152 VAL HG22 H 1 0.544 0.003 . . . . . A 152 VAL HG22 . 25855 1 1076 . 1 1 152 152 VAL HG23 H 1 0.544 0.003 . . . . . A 152 VAL HG23 . 25855 1 1077 . 1 1 152 152 VAL CA C 13 58.563 0.000 . . . . . A 152 VAL CA . 25855 1 1078 . 1 1 152 152 VAL CB C 13 34.117 0.000 . . . . . A 152 VAL CB . 25855 1 1079 . 1 1 152 152 VAL CG1 C 13 21.894 0.000 . . . . . A 152 VAL CG1 . 25855 1 1080 . 1 1 152 152 VAL CG2 C 13 17.642 0.000 . . . . . A 152 VAL CG2 . 25855 1 1081 . 1 1 153 153 ILE H H 1 8.972 0.016 . . . . . A 153 ILE H . 25855 1 1082 . 1 1 153 153 ILE HA H 1 4.628 0.005 . . . . . A 153 ILE HA . 25855 1 1083 . 1 1 153 153 ILE HB H 1 1.530 0.001 . . . . . A 153 ILE HB . 25855 1 1084 . 1 1 153 153 ILE HG12 H 1 1.406 0.005 . . . . . A 153 ILE HG12 . 25855 1 1085 . 1 1 153 153 ILE HG13 H 1 0.933 0.002 . . . . . A 153 ILE HG13 . 25855 1 1086 . 1 1 153 153 ILE HG21 H 1 0.459 0.002 . . . . . A 153 ILE HG21 . 25855 1 1087 . 1 1 153 153 ILE HG22 H 1 0.459 0.002 . . . . . A 153 ILE HG22 . 25855 1 1088 . 1 1 153 153 ILE HG23 H 1 0.459 0.002 . . . . . A 153 ILE HG23 . 25855 1 1089 . 1 1 153 153 ILE HD11 H 1 0.633 0.005 . . . . . A 153 ILE HD11 . 25855 1 1090 . 1 1 153 153 ILE HD12 H 1 0.633 0.005 . . . . . A 153 ILE HD12 . 25855 1 1091 . 1 1 153 153 ILE HD13 H 1 0.633 0.005 . . . . . A 153 ILE HD13 . 25855 1 1092 . 1 1 153 153 ILE CA C 13 61.220 0.000 . . . . . A 153 ILE CA . 25855 1 1093 . 1 1 153 153 ILE CB C 13 40.494 0.000 . . . . . A 153 ILE CB . 25855 1 1094 . 1 1 153 153 ILE CG1 C 13 27.740 0.000 . . . . . A 153 ILE CG1 . 25855 1 1095 . 1 1 153 153 ILE CG2 C 13 17.642 0.000 . . . . . A 153 ILE CG2 . 25855 1 1096 . 1 1 153 153 ILE CD1 C 13 13.922 0.000 . . . . . A 153 ILE CD1 . 25855 1 1097 . 1 1 154 154 VAL H H 1 8.557 0.003 . . . . . A 154 VAL H . 25855 1 1098 . 1 1 154 154 VAL HA H 1 4.234 0.014 . . . . . A 154 VAL HA . 25855 1 1099 . 1 1 154 154 VAL HB H 1 1.828 0.005 . . . . . A 154 VAL HB . 25855 1 1100 . 1 1 154 154 VAL HG11 H 1 0.786 0.005 . . . . . A 154 VAL HG11 . 25855 1 1101 . 1 1 154 154 VAL HG12 H 1 0.786 0.005 . . . . . A 154 VAL HG12 . 25855 1 1102 . 1 1 154 154 VAL HG13 H 1 0.786 0.005 . . . . . A 154 VAL HG13 . 25855 1 1103 . 1 1 154 154 VAL HG21 H 1 0.662 0.011 . . . . . A 154 VAL HG21 . 25855 1 1104 . 1 1 154 154 VAL HG22 H 1 0.662 0.011 . . . . . A 154 VAL HG22 . 25855 1 1105 . 1 1 154 154 VAL HG23 H 1 0.662 0.011 . . . . . A 154 VAL HG23 . 25855 1 1106 . 1 1 154 154 VAL CA C 13 61.752 0.000 . . . . . A 154 VAL CA . 25855 1 1107 . 1 1 154 154 VAL CB C 13 33.585 0.000 . . . . . A 154 VAL CB . 25855 1 1108 . 1 1 154 154 VAL CG1 C 13 22.425 0.000 . . . . . A 154 VAL CG1 . 25855 1 1109 . 1 1 154 154 VAL CG2 C 13 21.362 0.000 . . . . . A 154 VAL CG2 . 25855 1 1110 . 1 1 155 155 LYS H H 1 8.951 0.000 . . . . . A 155 LYS H . 25855 1 1111 . 1 1 155 155 LYS HA H 1 5.154 0.002 . . . . . A 155 LYS HA . 25855 1 1112 . 1 1 155 155 LYS HB2 H 1 1.634 0.002 . . . . . A 155 LYS HB2 . 25855 1 1113 . 1 1 155 155 LYS HB3 H 1 1.483 0.008 . . . . . A 155 LYS HB3 . 25855 1 1114 . 1 1 155 155 LYS HG2 H 1 1.071 0.005 . . . . . A 155 LYS HG2 . 25855 1 1115 . 1 1 155 155 LYS HG3 H 1 0.671 0.001 . . . . . A 155 LYS HG3 . 25855 1 1116 . 1 1 155 155 LYS HD2 H 1 1.469 0.014 . . . . . A 155 LYS HD2 . 25855 1 1117 . 1 1 155 155 LYS HD3 H 1 1.422 0.002 . . . . . A 155 LYS HD3 . 25855 1 1118 . 1 1 155 155 LYS HE2 H 1 2.556 0.001 . . . . . A 155 LYS HE2 . 25855 1 1119 . 1 1 155 155 LYS HE3 H 1 2.453 0.002 . . . . . A 155 LYS HE3 . 25855 1 1120 . 1 1 155 155 LYS CA C 13 54.843 0.000 . . . . . A 155 LYS CA . 25855 1 1121 . 1 1 155 155 LYS CB C 13 34.648 0.000 . . . . . A 155 LYS CB . 25855 1 1122 . 1 1 155 155 LYS CG C 13 25.082 0.000 . . . . . A 155 LYS CG . 25855 1 1123 . 1 1 155 155 LYS CD C 13 29.865 0.000 . . . . . A 155 LYS CD . 25855 1 1124 . 1 1 155 155 LYS CE C 13 41.557 0.000 . . . . . A 155 LYS CE . 25855 1 1125 . 1 1 156 156 ILE H H 1 9.538 0.008 . . . . . A 156 ILE H . 25855 1 1126 . 1 1 156 156 ILE HA H 1 5.035 0.005 . . . . . A 156 ILE HA . 25855 1 1127 . 1 1 156 156 ILE HB H 1 1.654 0.011 . . . . . A 156 ILE HB . 25855 1 1128 . 1 1 156 156 ILE HG12 H 1 1.502 0.003 . . . . . A 156 ILE HG12 . 25855 1 1129 . 1 1 156 156 ILE HG13 H 1 1.502 0.003 . . . . . A 156 ILE HG13 . 25855 1 1130 . 1 1 156 156 ILE HG21 H 1 0.805 0.007 . . . . . A 156 ILE HG21 . 25855 1 1131 . 1 1 156 156 ILE HG22 H 1 0.805 0.007 . . . . . A 156 ILE HG22 . 25855 1 1132 . 1 1 156 156 ILE HG23 H 1 0.805 0.007 . . . . . A 156 ILE HG23 . 25855 1 1133 . 1 1 156 156 ILE HD11 H 1 0.689 0.003 . . . . . A 156 ILE HD11 . 25855 1 1134 . 1 1 156 156 ILE HD12 H 1 0.689 0.003 . . . . . A 156 ILE HD12 . 25855 1 1135 . 1 1 156 156 ILE HD13 H 1 0.689 0.003 . . . . . A 156 ILE HD13 . 25855 1 1136 . 1 1 156 156 ILE CA C 13 60.157 0.000 . . . . . A 156 ILE CA . 25855 1 1137 . 1 1 156 156 ILE CB C 13 41.557 0.000 . . . . . A 156 ILE CB . 25855 1 1138 . 1 1 156 156 ILE CG1 C 13 28.071 0.000 . . . . . A 156 ILE CG1 . 25855 1 1139 . 1 1 156 156 ILE CG2 C 13 18.705 0.000 . . . . . A 156 ILE CG2 . 25855 1 1140 . 1 1 156 156 ILE CD1 C 13 15.516 0.000 . . . . . A 156 ILE CD1 . 25855 1 1141 . 1 1 157 157 ILE H H 1 9.468 0.001 . . . . . A 157 ILE H . 25855 1 1142 . 1 1 157 157 ILE HA H 1 5.101 0.008 . . . . . A 157 ILE HA . 25855 1 1143 . 1 1 157 157 ILE HB H 1 1.825 0.002 . . . . . A 157 ILE HB . 25855 1 1144 . 1 1 157 157 ILE HG12 H 1 1.429 0.001 . . . . . A 157 ILE HG12 . 25855 1 1145 . 1 1 157 157 ILE HG13 H 1 1.001 0.003 . . . . . A 157 ILE HG13 . 25855 1 1146 . 1 1 157 157 ILE HG21 H 1 0.760 0.003 . . . . . A 157 ILE HG21 . 25855 1 1147 . 1 1 157 157 ILE HG22 H 1 0.760 0.003 . . . . . A 157 ILE HG22 . 25855 1 1148 . 1 1 157 157 ILE HG23 H 1 0.760 0.003 . . . . . A 157 ILE HG23 . 25855 1 1149 . 1 1 157 157 ILE HD11 H 1 0.766 0.001 . . . . . A 157 ILE HD11 . 25855 1 1150 . 1 1 157 157 ILE HD12 H 1 0.766 0.001 . . . . . A 157 ILE HD12 . 25855 1 1151 . 1 1 157 157 ILE HD13 H 1 0.766 0.001 . . . . . A 157 ILE HD13 . 25855 1 1152 . 1 1 157 157 ILE CA C 13 60.689 0.000 . . . . . A 157 ILE CA . 25855 1 1153 . 1 1 157 157 ILE CB C 13 40.494 0.000 . . . . . A 157 ILE CB . 25855 1 1154 . 1 1 157 157 ILE CG1 C 13 28.802 0.000 . . . . . A 157 ILE CG1 . 25855 1 1155 . 1 1 157 157 ILE CG2 C 13 18.705 0.000 . . . . . A 157 ILE CG2 . 25855 1 1156 . 1 1 157 157 ILE CD1 C 13 14.454 0.000 . . . . . A 157 ILE CD1 . 25855 1 1157 . 1 1 158 158 GLY H H 1 8.236 0.006 . . . . . A 158 GLY H . 25855 1 1158 . 1 1 158 158 GLY HA2 H 1 3.976 0.002 . . . . . A 158 GLY HA2 . 25855 1 1159 . 1 1 158 158 GLY HA3 H 1 4.382 0.002 . . . . . A 158 GLY HA3 . 25855 1 1160 . 1 1 158 158 GLY CA C 13 45.809 0.000 . . . . . A 158 GLY CA . 25855 1 1161 . 1 1 159 159 HIS H H 1 7.986 0.000 . . . . . A 159 HIS H . 25855 1 1162 . 1 1 159 159 HIS HA H 1 5.545 0.002 . . . . . A 159 HIS HA . 25855 1 1163 . 1 1 159 159 HIS HB2 H 1 3.509 0.002 . . . . . A 159 HIS HB2 . 25855 1 1164 . 1 1 159 159 HIS HB3 H 1 3.168 0.008 . . . . . A 159 HIS HB3 . 25855 1 1165 . 1 1 159 159 HIS HD2 H 1 7.060 0.000 . . . . . A 159 HIS HD2 . 25855 1 1166 . 1 1 159 159 HIS CA C 13 55.375 0.000 . . . . . A 159 HIS CA . 25855 1 1167 . 1 1 159 159 HIS CB C 13 31.460 0.000 . . . . . A 159 HIS CB . 25855 1 1168 . 1 1 160 160 PHE HA H 1 3.186 0.000 . . . . . A 160 PHE HA . 25855 1 1169 . 1 1 160 160 PHE HB2 H 1 2.339 0.006 . . . . . A 160 PHE HB2 . 25855 1 1170 . 1 1 160 160 PHE HB3 H 1 2.146 0.008 . . . . . A 160 PHE HB3 . 25855 1 1171 . 1 1 160 160 PHE HD1 H 1 6.348 0.000 . . . . . A 160 PHE HD1 . 25855 1 1172 . 1 1 160 160 PHE HD2 H 1 6.348 0.000 . . . . . A 160 PHE HD2 . 25855 1 1173 . 1 1 160 160 PHE CA C 13 62.283 0.000 . . . . . A 160 PHE CA . 25855 1 1174 . 1 1 160 160 PHE CB C 13 38.368 0.000 . . . . . A 160 PHE CB . 25855 1 1175 . 1 1 161 161 TYR HA H 1 3.440 0.007 . . . . . A 161 TYR HA . 25855 1 1176 . 1 1 161 161 TYR HB2 H 1 2.986 0.007 . . . . . A 161 TYR HB2 . 25855 1 1177 . 1 1 161 161 TYR HB3 H 1 2.986 0.007 . . . . . A 161 TYR HB3 . 25855 1 1178 . 1 1 161 161 TYR HD1 H 1 7.120 0.000 . . . . . A 161 TYR HD1 . 25855 1 1179 . 1 1 161 161 TYR HD2 H 1 7.120 0.000 . . . . . A 161 TYR HD2 . 25855 1 1180 . 1 1 161 161 TYR CA C 13 62.283 0.000 . . . . . A 161 TYR CA . 25855 1 1181 . 1 1 161 161 TYR CB C 13 37.837 0.000 . . . . . A 161 TYR CB . 25855 1 1182 . 1 1 162 162 ALA H H 1 7.458 0.000 . . . . . A 162 ALA H . 25855 1 1183 . 1 1 162 162 ALA HA H 1 4.052 0.005 . . . . . A 162 ALA HA . 25855 1 1184 . 1 1 162 162 ALA HB1 H 1 0.978 0.003 . . . . . A 162 ALA HB1 . 25855 1 1185 . 1 1 162 162 ALA HB2 H 1 0.978 0.003 . . . . . A 162 ALA HB2 . 25855 1 1186 . 1 1 162 162 ALA HB3 H 1 0.978 0.003 . . . . . A 162 ALA HB3 . 25855 1 1187 . 1 1 162 162 ALA CA C 13 54.843 0.000 . . . . . A 162 ALA CA . 25855 1 1188 . 1 1 162 162 ALA CB C 13 18.705 0.000 . . . . . A 162 ALA CB . 25855 1 1189 . 1 1 163 163 SER H H 1 8.403 0.005 . . . . . A 163 SER H . 25855 1 1190 . 1 1 163 163 SER HA H 1 3.832 0.003 . . . . . A 163 SER HA . 25855 1 1191 . 1 1 163 163 SER HB2 H 1 3.732 0.039 . . . . . A 163 SER HB2 . 25855 1 1192 . 1 1 163 163 SER HB3 H 1 3.732 0.039 . . . . . A 163 SER HB3 . 25855 1 1193 . 1 1 163 163 SER CA C 13 60.050 0.000 . . . . . A 163 SER CA . 25855 1 1194 . 1 1 163 163 SER CB C 13 63.346 0.000 . . . . . A 163 SER CB . 25855 1 1195 . 1 1 164 164 GLN HA H 1 3.610 0.003 . . . . . A 164 GLN HA . 25855 1 1196 . 1 1 164 164 GLN HB2 H 1 10.461 12.452 . . . . . A 164 GLN HB2 . 25855 1 1197 . 1 1 164 164 GLN HB3 H 1 14.780 13.291 . . . . . A 164 GLN HB3 . 25855 1 1198 . 1 1 164 164 GLN HG2 H 1 1.888 0.000 . . . . . A 164 GLN HG2 . 25855 1 1199 . 1 1 164 164 GLN HG3 H 1 1.888 0.000 . . . . . A 164 GLN HG3 . 25855 1 1200 . 1 1 164 164 GLN CA C 13 58.563 0.000 . . . . . A 164 GLN CA . 25855 1 1201 . 1 1 164 164 GLN CB C 13 6.594 10.042 . . . . . A 164 GLN CB . 25855 1 1202 . 1 1 165 165 MET HA H 1 4.048 0.007 . . . . . A 165 MET HA . 25855 1 1203 . 1 1 165 165 MET HB2 H 1 2.166 0.004 . . . . . A 165 MET HB2 . 25855 1 1204 . 1 1 165 165 MET HB3 H 1 2.166 0.004 . . . . . A 165 MET HB3 . 25855 1 1205 . 1 1 165 165 MET HG2 H 1 2.565 0.005 . . . . . A 165 MET HG2 . 25855 1 1206 . 1 1 165 165 MET HG3 H 1 2.327 0.030 . . . . . A 165 MET HG3 . 25855 1 1207 . 1 1 165 165 MET HE1 H 1 1.979 0.001 . . . . . A 165 MET HE1 . 25855 1 1208 . 1 1 165 165 MET HE2 H 1 1.979 0.001 . . . . . A 165 MET HE2 . 25855 1 1209 . 1 1 165 165 MET HE3 H 1 1.979 0.001 . . . . . A 165 MET HE3 . 25855 1 1210 . 1 1 165 165 MET CA C 13 58.563 0.000 . . . . . A 165 MET CA . 25855 1 1211 . 1 1 165 165 MET CB C 13 31.991 0.000 . . . . . A 165 MET CB . 25855 1 1212 . 1 1 165 165 MET CG C 13 32.523 0.000 . . . . . A 165 MET CG . 25855 1 1213 . 1 1 165 165 MET CE C 13 17.077 0.000 . . . . . A 165 MET CE . 25855 1 1214 . 1 1 166 166 ALA H H 1 8.208 0.004 . . . . . A 166 ALA H . 25855 1 1215 . 1 1 166 166 ALA HA H 1 3.918 0.000 . . . . . A 166 ALA HA . 25855 1 1216 . 1 1 166 166 ALA HB1 H 1 1.311 0.006 . . . . . A 166 ALA HB1 . 25855 1 1217 . 1 1 166 166 ALA HB2 H 1 1.311 0.006 . . . . . A 166 ALA HB2 . 25855 1 1218 . 1 1 166 166 ALA HB3 H 1 1.311 0.006 . . . . . A 166 ALA HB3 . 25855 1 1219 . 1 1 166 166 ALA CB C 13 18.076 0.000 . . . . . A 166 ALA CB . 25855 1 1220 . 1 1 167 167 GLN H H 1 8.393 0.000 . . . . . A 167 GLN H . 25855 1 1221 . 1 1 167 167 GLN HA H 1 3.628 0.004 . . . . . A 167 GLN HA . 25855 1 1222 . 1 1 167 167 GLN HB2 H 1 2.168 0.008 . . . . . A 167 GLN HB2 . 25855 1 1223 . 1 1 167 167 GLN HB3 H 1 2.048 0.000 . . . . . A 167 GLN HB3 . 25855 1 1224 . 1 1 167 167 GLN HG2 H 1 2.493 0.004 . . . . . A 167 GLN HG2 . 25855 1 1225 . 1 1 167 167 GLN HG3 H 1 1.819 0.006 . . . . . A 167 GLN HG3 . 25855 1 1226 . 1 1 167 167 GLN CA C 13 60.157 0.000 . . . . . A 167 GLN CA . 25855 1 1227 . 1 1 167 167 GLN CG C 13 36.774 0.000 . . . . . A 167 GLN CG . 25855 1 1228 . 1 1 168 168 ARG H H 1 8.220 0.002 . . . . . A 168 ARG H . 25855 1 1229 . 1 1 168 168 ARG HA H 1 3.890 0.008 . . . . . A 168 ARG HA . 25855 1 1230 . 1 1 168 168 ARG HB2 H 1 1.890 0.005 . . . . . A 168 ARG HB2 . 25855 1 1231 . 1 1 168 168 ARG HB3 H 1 1.890 0.005 . . . . . A 168 ARG HB3 . 25855 1 1232 . 1 1 168 168 ARG HG2 H 1 1.706 0.000 . . . . . A 168 ARG HG2 . 25855 1 1233 . 1 1 168 168 ARG HG3 H 1 1.706 0.000 . . . . . A 168 ARG HG3 . 25855 1 1234 . 1 1 168 168 ARG HD2 H 1 3.124 0.012 . . . . . A 168 ARG HD2 . 25855 1 1235 . 1 1 168 168 ARG HD3 H 1 3.124 0.012 . . . . . A 168 ARG HD3 . 25855 1 1236 . 1 1 168 168 ARG CA C 13 53.036 8.071 . . . . . A 168 ARG CA . 25855 1 1237 . 1 1 168 168 ARG CB C 13 29.865 0.000 . . . . . A 168 ARG CB . 25855 1 1238 . 1 1 169 169 LYS H H 1 8.042 0.000 . . . . . A 169 LYS H . 25855 1 1239 . 1 1 169 169 LYS HA H 1 4.133 0.007 . . . . . A 169 LYS HA . 25855 1 1240 . 1 1 169 169 LYS HB2 H 1 1.842 0.004 . . . . . A 169 LYS HB2 . 25855 1 1241 . 1 1 169 169 LYS HB3 H 1 1.842 0.004 . . . . . A 169 LYS HB3 . 25855 1 1242 . 1 1 169 169 LYS HG2 H 1 1.483 0.004 . . . . . A 169 LYS HG2 . 25855 1 1243 . 1 1 169 169 LYS HG3 H 1 1.404 0.002 . . . . . A 169 LYS HG3 . 25855 1 1244 . 1 1 169 169 LYS HE2 H 1 2.934 0.000 . . . . . A 169 LYS HE2 . 25855 1 1245 . 1 1 169 169 LYS HE3 H 1 2.934 0.000 . . . . . A 169 LYS HE3 . 25855 1 1246 . 1 1 169 169 LYS CA C 13 58.563 0.000 . . . . . A 169 LYS CA . 25855 1 1247 . 1 1 169 169 LYS CB C 13 31.991 0.000 . . . . . A 169 LYS CB . 25855 1 1248 . 1 1 169 169 LYS CG C 13 25.082 0.000 . . . . . A 169 LYS CG . 25855 1 1249 . 1 1 170 170 ILE H H 1 8.190 0.005 . . . . . A 170 ILE H . 25855 1 1250 . 1 1 170 170 ILE HA H 1 3.530 0.008 . . . . . A 170 ILE HA . 25855 1 1251 . 1 1 170 170 ILE HB H 1 1.791 0.006 . . . . . A 170 ILE HB . 25855 1 1252 . 1 1 170 170 ILE HG12 H 1 0.804 0.000 . . . . . A 170 ILE HG12 . 25855 1 1253 . 1 1 170 170 ILE HG13 H 1 0.804 0.000 . . . . . A 170 ILE HG13 . 25855 1 1254 . 1 1 170 170 ILE HG21 H 1 0.700 0.001 . . . . . A 170 ILE HG21 . 25855 1 1255 . 1 1 170 170 ILE HG22 H 1 0.700 0.001 . . . . . A 170 ILE HG22 . 25855 1 1256 . 1 1 170 170 ILE HG23 H 1 0.700 0.001 . . . . . A 170 ILE HG23 . 25855 1 1257 . 1 1 170 170 ILE HD11 H 1 0.632 0.003 . . . . . A 170 ILE HD11 . 25855 1 1258 . 1 1 170 170 ILE HD12 H 1 0.632 0.003 . . . . . A 170 ILE HD12 . 25855 1 1259 . 1 1 170 170 ILE HD13 H 1 0.632 0.003 . . . . . A 170 ILE HD13 . 25855 1 1260 . 1 1 170 170 ILE CA C 13 65.472 0.000 . . . . . A 170 ILE CA . 25855 1 1261 . 1 1 170 170 ILE CB C 13 36.774 0.000 . . . . . A 170 ILE CB . 25855 1 1262 . 1 1 170 170 ILE CG2 C 13 16.077 0.000 . . . . . A 170 ILE CG2 . 25855 1 1263 . 1 1 170 170 ILE CD1 C 13 13.922 0.000 . . . . . A 170 ILE CD1 . 25855 1 1264 . 1 1 171 171 ARG H H 1 7.984 0.016 . . . . . A 171 ARG H . 25855 1 1265 . 1 1 171 171 ARG HA H 1 3.867 0.009 . . . . . A 171 ARG HA . 25855 1 1266 . 1 1 171 171 ARG HB2 H 1 2.023 0.003 . . . . . A 171 ARG HB2 . 25855 1 1267 . 1 1 171 171 ARG HB3 H 1 2.023 0.003 . . . . . A 171 ARG HB3 . 25855 1 1268 . 1 1 171 171 ARG HG2 H 1 1.858 0.005 . . . . . A 171 ARG HG2 . 25855 1 1269 . 1 1 171 171 ARG HG3 H 1 1.715 0.002 . . . . . A 171 ARG HG3 . 25855 1 1270 . 1 1 171 171 ARG HD2 H 1 3.154 0.004 . . . . . A 171 ARG HD2 . 25855 1 1271 . 1 1 171 171 ARG HD3 H 1 3.154 0.004 . . . . . A 171 ARG HD3 . 25855 1 1272 . 1 1 171 171 ARG CA C 13 60.051 0.212 . . . . . A 171 ARG CA . 25855 1 1273 . 1 1 171 171 ARG CB C 13 29.334 0.000 . . . . . A 171 ARG CB . 25855 1 1274 . 1 1 171 171 ARG CG C 13 27.740 0.000 . . . . . A 171 ARG CG . 25855 1 1275 . 1 1 171 171 ARG CD C 13 43.151 0.000 . . . . . A 171 ARG CD . 25855 1 1276 . 1 1 172 172 ASP H H 1 7.993 0.004 . . . . . A 172 ASP H . 25855 1 1277 . 1 1 172 172 ASP HA H 1 4.429 0.005 . . . . . A 172 ASP HA . 25855 1 1278 . 1 1 172 172 ASP HB2 H 1 2.885 0.003 . . . . . A 172 ASP HB2 . 25855 1 1279 . 1 1 172 172 ASP HB3 H 1 2.673 0.007 . . . . . A 172 ASP HB3 . 25855 1 1280 . 1 1 172 172 ASP CA C 13 57.500 0.000 . . . . . A 172 ASP CA . 25855 1 1281 . 1 1 172 172 ASP CB C 13 40.494 0.000 . . . . . A 172 ASP CB . 25855 1 1282 . 1 1 173 173 ILE HA H 1 3.650 0.001 . . . . . A 173 ILE HA . 25855 1 1283 . 1 1 173 173 ILE HB H 1 1.948 0.001 . . . . . A 173 ILE HB . 25855 1 1284 . 1 1 173 173 ILE HG12 H 1 1.818 0.004 . . . . . A 173 ILE HG12 . 25855 1 1285 . 1 1 173 173 ILE HG13 H 1 1.008 0.006 . . . . . A 173 ILE HG13 . 25855 1 1286 . 1 1 173 173 ILE HD11 H 1 0.771 0.014 . . . . . A 173 ILE HD11 . 25855 1 1287 . 1 1 173 173 ILE HD12 H 1 0.771 0.014 . . . . . A 173 ILE HD12 . 25855 1 1288 . 1 1 173 173 ILE HD13 H 1 0.771 0.014 . . . . . A 173 ILE HD13 . 25855 1 1289 . 1 1 173 173 ILE CA C 13 65.472 0.000 . . . . . A 173 ILE CA . 25855 1 1290 . 1 1 173 173 ILE CB C 13 38.368 0.000 . . . . . A 173 ILE CB . 25855 1 1291 . 1 1 173 173 ILE CG1 C 13 29.334 0.000 . . . . . A 173 ILE CG1 . 25855 1 1292 . 1 1 173 173 ILE CD1 C 13 13.922 0.000 . . . . . A 173 ILE CD1 . 25855 1 1293 . 1 1 174 174 LEU H H 1 8.270 0.000 . . . . . A 174 LEU H . 25855 1 1294 . 1 1 174 174 LEU HA H 1 3.895 0.002 . . . . . A 174 LEU HA . 25855 1 1295 . 1 1 174 174 LEU HB2 H 1 1.869 0.002 . . . . . A 174 LEU HB2 . 25855 1 1296 . 1 1 174 174 LEU HB3 H 1 1.519 0.005 . . . . . A 174 LEU HB3 . 25855 1 1297 . 1 1 174 174 LEU HG H 1 1.881 0.009 . . . . . A 174 LEU HG . 25855 1 1298 . 1 1 174 174 LEU HD11 H 1 0.853 0.005 . . . . . A 174 LEU HD11 . 25855 1 1299 . 1 1 174 174 LEU HD12 H 1 0.853 0.005 . . . . . A 174 LEU HD12 . 25855 1 1300 . 1 1 174 174 LEU HD13 H 1 0.853 0.005 . . . . . A 174 LEU HD13 . 25855 1 1301 . 1 1 174 174 LEU HD21 H 1 0.722 0.002 . . . . . A 174 LEU HD21 . 25855 1 1302 . 1 1 174 174 LEU HD22 H 1 0.722 0.002 . . . . . A 174 LEU HD22 . 25855 1 1303 . 1 1 174 174 LEU HD23 H 1 0.722 0.002 . . . . . A 174 LEU HD23 . 25855 1 1304 . 1 1 174 174 LEU CA C 13 57.500 0.000 . . . . . A 174 LEU CA . 25855 1 1305 . 1 1 174 174 LEU CB C 13 41.026 0.000 . . . . . A 174 LEU CB . 25855 1 1306 . 1 1 174 174 LEU CG C 13 26.677 0.000 . . . . . A 174 LEU CG . 25855 1 1307 . 1 1 174 174 LEU CD1 C 13 25.614 0.000 . . . . . A 174 LEU CD1 . 25855 1 1308 . 1 1 174 174 LEU CD2 C 13 22.957 0.000 . . . . . A 174 LEU CD2 . 25855 1 1309 . 1 1 175 175 ALA H H 1 7.960 0.002 . . . . . A 175 ALA H . 25855 1 1310 . 1 1 175 175 ALA HA H 1 4.144 0.003 . . . . . A 175 ALA HA . 25855 1 1311 . 1 1 175 175 ALA HB1 H 1 1.532 0.002 . . . . . A 175 ALA HB1 . 25855 1 1312 . 1 1 175 175 ALA HB2 H 1 1.532 0.002 . . . . . A 175 ALA HB2 . 25855 1 1313 . 1 1 175 175 ALA HB3 H 1 1.532 0.002 . . . . . A 175 ALA HB3 . 25855 1 1314 . 1 1 175 175 ALA CA C 13 54.056 0.000 . . . . . A 175 ALA CA . 25855 1 1315 . 1 1 175 175 ALA CB C 13 18.705 0.000 . . . . . A 175 ALA CB . 25855 1 1316 . 1 1 176 176 GLN H H 1 7.696 0.006 . . . . . A 176 GLN H . 25855 1 1317 . 1 1 176 176 GLN HA H 1 4.093 0.003 . . . . . A 176 GLN HA . 25855 1 1318 . 1 1 176 176 GLN HB2 H 1 2.150 0.047 . . . . . A 176 GLN HB2 . 25855 1 1319 . 1 1 176 176 GLN HB3 H 1 2.150 0.047 . . . . . A 176 GLN HB3 . 25855 1 1320 . 1 1 176 176 GLN HG2 H 1 2.523 0.003 . . . . . A 176 GLN HG2 . 25855 1 1321 . 1 1 176 176 GLN HG3 H 1 2.353 0.004 . . . . . A 176 GLN HG3 . 25855 1 1322 . 1 1 176 176 GLN HE21 H 1 7.330 0.001 . . . . . A 176 GLN HE21 . 25855 1 1323 . 1 1 176 176 GLN HE22 H 1 6.753 0.000 . . . . . A 176 GLN HE22 . 25855 1 1324 . 1 1 176 176 GLN CA C 13 58.054 0.000 . . . . . A 176 GLN CA . 25855 1 1325 . 1 1 176 176 GLN CB C 13 29.070 0.000 . . . . . A 176 GLN CB . 25855 1 1326 . 1 1 176 176 GLN CG C 13 34.067 0.000 . . . . . A 176 GLN CG . 25855 1 1327 . 1 1 177 177 VAL H H 1 7.850 0.001 . . . . . A 177 VAL H . 25855 1 1328 . 1 1 177 177 VAL HA H 1 3.825 0.002 . . . . . A 177 VAL HA . 25855 1 1329 . 1 1 177 177 VAL HB H 1 2.164 0.006 . . . . . A 177 VAL HB . 25855 1 1330 . 1 1 177 177 VAL HG11 H 1 0.974 0.003 . . . . . A 177 VAL HG11 . 25855 1 1331 . 1 1 177 177 VAL HG12 H 1 0.974 0.003 . . . . . A 177 VAL HG12 . 25855 1 1332 . 1 1 177 177 VAL HG13 H 1 0.974 0.003 . . . . . A 177 VAL HG13 . 25855 1 1333 . 1 1 177 177 VAL HG21 H 1 0.879 0.003 . . . . . A 177 VAL HG21 . 25855 1 1334 . 1 1 177 177 VAL HG22 H 1 0.879 0.003 . . . . . A 177 VAL HG22 . 25855 1 1335 . 1 1 177 177 VAL HG23 H 1 0.879 0.003 . . . . . A 177 VAL HG23 . 25855 1 1336 . 1 1 177 177 VAL CA C 13 64.051 0.000 . . . . . A 177 VAL CA . 25855 1 1337 . 1 1 177 177 VAL CB C 13 32.068 0.000 . . . . . A 177 VAL CB . 25855 1 1338 . 1 1 177 177 VAL CG1 C 13 22.074 0.000 . . . . . A 177 VAL CG1 . 25855 1 1339 . 1 1 177 177 VAL CG2 C 13 21.074 0.000 . . . . . A 177 VAL CG2 . 25855 1 1340 . 1 1 178 178 LYS HB2 H 1 1.844 0.000 . . . . . A 178 LYS HB2 . 25855 1 1341 . 1 1 178 178 LYS HB3 H 1 1.844 0.000 . . . . . A 178 LYS HB3 . 25855 1 1342 . 1 1 179 179 GLN H H 1 7.862 0.000 . . . . . A 179 GLN H . 25855 1 1343 . 1 1 179 179 GLN HB2 H 1 2.061 0.000 . . . . . A 179 GLN HB2 . 25855 1 1344 . 1 1 179 179 GLN HB3 H 1 2.061 0.000 . . . . . A 179 GLN HB3 . 25855 1 stop_ save_